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Profile: C/D/N Isotopes Inc. manufactures deuterium labelled compounds. Our products are alkanes, amino acids, fatty acids, hydrocarbon gases, pesticides & pesticide metabolites and steroids.

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• Dimethyl phthalate

IUPAC Name: dimethyl benzene-1,2-dicarboxylate | CAS Registry Number: 131-11-3
Synonyms: Solvarone, Solvanom, Fermine, Avolin, Mipax, Palatinol M, Repeftal, Unimoll DM, Dimethyl o-phthalate, Methyl phthalate, Caswell No. 380, DIMETHYLPHTHALATE, DMF (insect repellant), DMF, insect repellent, Phthalsaeuredimethylester, RCRA waste no. U102, Phthalic acid, dimethyl ester, RCRA waste number U102, Phthalic acid dimethyl ester, Dimethyl benzene-o-dicarboxylate

Molecular Formula:	C₁₀H₁₀O₄	Molecular Weight:	194.184000 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: NIQCNGHVCWTJSM-UHFFFAOYSA-N

• Dimethyl terephthalate

IUPAC Name: dimethyl benzene-1,4-dicarboxylate | CAS Registry Number: 120-61-6
Synonyms: DIMETHYL TEREPHTHALATE, Dimethyl p-phthalate, Di-Me terephthalate, Dimethyl 4-phthalate, Methyl terephthalate, Terephthalic acid, dimethyl ester, Dimethyl p-benzenedicarboxylate, Methyl 4-carbomethoxybenzoate, CCRIS 266, Terephthalic acid methyl ester, WLN: 1OVR DVO1, Dimethyl 1,4-benzenedicarboxylate, TimTec1_001016, NCI-C50055, 1,4-Benzenedicarboxylic acid, dimethyl ester, HSDB 2580, Methyl p-(methoxycarbonyl)benzoate, 185124_ALDRICH, 36910_RIEDEL, Methyl 4-(carbomethoxy)benzoate

Molecular Formula:	C₁₀H₁₀O₄	Molecular Weight:	194.184000 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: WOZVHXUHUFLZGK-UHFFFAOYSA-N

• Dimethyl-d6 Sulfoxide

IUPAC Name: trideuterio(trideuteriomethylsulfinyl)methane | CAS Registry Number: 2206-27-1
Synonyms: Dimethylsulfoxide-D6, Dimethyl sulfoxide-d6, (Methyl sulfoxide)-d6, DMSO-d6, Methane-D3-, sulfinylbis-, Methane-d3, sulfinylbis-, Hexadeuterodimethyl sulfoxide, Hexadeuteriodimethyl sulfoxide, Di((2H3)methyl) sulphoxide, 151874_ALDRICH, 156914_ALDRICH, 175943_ALDRICH, 185965_ALDRICH, 236926_ALDRICH, 236934_ALDRICH, 296147_ALDRICH, 308838_ALDRICH, 417904_ALDRICH, 417912_ALDRICH, 417920_ALDRICH

Molecular Formula:	C₂H₆OS	Molecular Weight:	84.170411 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: IAZDPXIOMUYVGZ-WFGJKAKNSA-N

• Dipropyl phthalate

IUPAC Name: dipropyl benzene-1,2-dicarboxylate | CAS Registry Number: 131-16-8
Synonyms: Di-n-propylphthalate, N-Dipropyl phthalate, DI-N-PROPYL PHTHALATE, Di-PrP, Phthalic acid, dipropyl ester, 290602_ALDRICH, 45624_RIEDEL, 1,2-Benzenedicarboxylic acid, dipropyl ester, 80156_FLUKA, EINECS 205-015-8, NSC 15314, NSC15314, BRN 2332522, LS-738, SBB008002, ZINC01706878, AI3-01767, FR-0732, NCGC00090783-01, NCGC00090783-02

Molecular Formula:	C₁₄H₁₈O₄	Molecular Weight:	250.290320 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: MQHNKCZKNAJROC-UHFFFAOYSA-N

• DL-2-Aminobutyric-D6 acid

IUPAC Name: 2-amino-2,3,3,4,4,4-hexadeuteriobutanoic acid | CAS Registry Number: 350820-17-6
Synonyms: SCHEMBL18825499, ACM350820176

Molecular Formula:	C₄H₉NO₂	Molecular Weight:	109.158 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: QWCKQJZIFLGMSD-LIDOUZCJSA-N

• DL-Glutamic-2,4,4-D3 acid

IUPAC Name: 2-amino-2,4,4-trideuteriopentanedioic acid | CAS Registry Number: 96927-56-9
Synonyms: SCHEMBL410664, DL-Glutamic acid-2,4,4-d3, DL-GLUTAMIC-2,4,4-D3ACID, 2-Aminopentanedioic acid-2,4,4-d3

Molecular Formula:	C₅H₉NO₄	Molecular Weight:	150.147745 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: WHUUTDBJXJRKMK-UHVFUKFASA-N

• DL-Mevalonolactone-4,4,5,5-D4

IUPAC Name: 5,5,6,6-tetradeuterio-4-hydroxy-4-methyloxan-2-one | CAS Registry Number: 349553-98-6
Synonyms: DL-MEVALONOLACTONE-4,4,5,5-D4

Molecular Formula:	C₆H₁₀O₃	Molecular Weight:	134.166447 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: JYVXNLLUYHCIIH-RRVWJQJTSA-N

• DNHP

IUPAC Name: dihexyl benzene-1,2-dicarboxylate | CAS Registry Number: 84-75-3
Synonyms: Di-n-hexyl phthalate, DIHEXYL PHTHALATE, Di-n-hexylphthalate, N-Dihexyl phthalate, Di(n-hexyl)phthalate, Phthalic acid, dihexyl ester, Bis(n-hexyl) phthalate, Hexyl phthalate, 1,2-, Dihexyl 1,2-benzenedicarboxylate, phthalic acid dihexyl ester, WLN: 6OVR BVO6, CCRIS 6192, HSDB 4490, 1,2-Benzenedicarboxylic acid, dihexyl ester, NSC 4817, AI3-04274 (USDA), EINECS 201-559-5, 1,2-Benzenedioic acid dihexyl ester, NSC4817, Dihexylester kyseliny ftalove [Czech]

Molecular Formula:	C₂₀H₃₀O₄	Molecular Weight:	334.449800 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: KCXZNSGUUQJJTR-UHFFFAOYSA-N

• Docosanoic acid

IUPAC Name: docosanoic acid | CAS Registry Number: 112-85-6
Synonyms: Behenic acid, Docosoic acid, Docosanoate, 1-Docosanoic acid, Docosansaeure, Dokosansaeure, Behensaeure, N-DOCOSANOIC ACID, Docosanic acid, Hydrofol Acid 560, Glycon B-70, Hydrofol 2022-55, BEHENIC ACID, REAG, BEHENIC ACID, 85%, HSDB 5578, 216941_ALDRICH, CH3-[CH2]20-COOH, 11909_FLUKA, CHEBI:28941, EINECS 204-010-8

Molecular Formula:	C₂₂H₄₄O₂	Molecular Weight:	340.583560 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: UKMSUNONTOPOIO-UHFFFAOYSA-N

• Ethanol-D

IUPAC Name: deuteriooxyethane | CAS Registry Number: 925-93-9
Synonyms: Ethanol-d, Ethanol-d1, Ethanol-OD, Ethyl alcohol-d1, Ethan(ol-d), Ethyl (2)alcohol, Ethyl alcohol and water, 5%, 151904_ALDRICH, 452556_ALDRICH, EINECS 213-128-9, CID123093, 1624-36-8

Molecular Formula:	C₂H₆O	Molecular Weight:	47.074602 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: LFQSCWFLJHTTHZ-WFVSFCRTSA-N

• Ethanol-D6

IUPAC Name: 1,1,1,2,2-pentadeuterio-2-deuteriooxyethane | CAS Registry Number: 1516-08-1
Synonyms: Hexadeuteroethanol, Ethanol-d6, Ethyl alcohol-d6, Ethanol-d6-, Ethyl-d5 alcohol-d, (2H6)Ethanol, Ethyl alcohol and water, 5%, 186414_ALDRICH, EINECS 216-162-2, CID102138

Molecular Formula:	C₂H₆O	Molecular Weight:	52.105411 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: LFQSCWFLJHTTHZ-LIDOUZCJSA-N

• Ethyl-2,2,2-D3 Alcohol

IUPAC Name: 2,2,2-trideuterioethanol | CAS Registry Number: 1759-87-1
Synonyms: Ethanol-2,2,2-d3, Ethyl alcohol-2,2,2-d3, Ethanol-d3, AC1LASDN, 2,2,2-trideuterioethanol, C2H3D3O, 329347_ALDRICH, AKOS015910285, E0357, FT-0625732, I14-40088

Molecular Formula:	C₂H₆O	Molecular Weight:	49.086925 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: LFQSCWFLJHTTHZ-FIBGUPNXSA-N

• Formic Acid C-D

IUPAC Name: protioformic acid | CAS Registry Number: 917-71-5
Synonyms: Formic-d acid, Formic acid magnesium salt, CID136699

Molecular Formula:	CH₂O₂	Molecular Weight:	46.025265 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: BDAGIHXWWSANSR-GXEIOEIKSA-N

• Formic Acid O-D

IUPAC Name: deuterio formate | CAS Registry Number: 925-94-0
Synonyms: Formic acid-d, Formic Acid O-d, Formic (2H)acid, 489441_ALDRICH, EINECS 213-129-4, F0247, FT-0626537

Molecular Formula:	CH₂O₂	Molecular Weight:	47.031542 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: BDAGIHXWWSANSR-DYCDLGHISA-N

• Hexadecanoic-9,9-D2 acid

IUPAC Name: 9,9-dideuteriohexadecanoic acid | CAS Registry Number: 272442-14-5
Synonyms: Hexadecanoic-9,9-d2 acid, ACM272442145

Molecular Formula:	C₁₆H₃₂O₂	Molecular Weight:	258.442 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: IPCSVZSSVZVIGE-MGVXTIMCSA-N

• Isophthalic acid

IUPAC Name: benzene-1,3-dicarboxylic acid | CAS Registry Number: 121-91-5
Synonyms: ISOPHTHALIC ACID, m-Phthalic acid, Isophthalate, 1,3-Benzenedicarboxylic acid, Acide isophtalique, Kyselina isoftalova, m-Benzenedicarboxylic acid, Benzene-1,3-dicarboxylic acid, Acide isophtalique [French], Kyselina isoftalova [Czech], WLN: QVR CVQ, I19209_ALDRICH, HSDB 2090, MLS001075180, CHEBI:30802, EINECS 204-506-4, CID8496, NSC 15310, AIDS018124, AIDS-018124

Molecular Formula:	C₈H₆O₄	Molecular Weight:	166.130840 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: QQVIHTHCMHWDBS-UHFFFAOYSA-N

• L-Alanine-D7

IUPAC Name: deuterio (2S)-2,3,3,3-tetradeuterio-2-(dideuterioamino)propanoate | CAS Registry Number: 74280-71-0
Synonyms: l-alanine-d7, L-Alanine-d7, 98 atom % D, 98% (CP)

Molecular Formula:	C₃H₇NO₂	Molecular Weight:	96.137 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: QNAYBMKLOCPYGJ-VQIVFXRSSA-N

• L-Phenyl-D5-alanine

IUPAC Name: (2S)-2-amino-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid | CAS Registry Number: 56253-90-8

Molecular Formula:	C₉H₁₁NO₂	Molecular Weight:	170.219949 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: COLNVLDHVKWLRT-HRVDQBBZSA-N

• Melatonin

IUPAC Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide | CAS Registry Number: 73-31-4
Synonyms: Melatonine, Circadin, N-Acetyl-5-methoxytryptamine, Melapure, Melovine, Posidorm, Melatol, Regulin, 5-Methoxy-N-acetyltryptamine, Prestwick_312, Spectrum_000185, Prestwick0_000458, Prestwick1_000458, Prestwick2_000458, Prestwick3_000458, Spectrum2_001344, Spectrum3_001393, Spectrum4_000066, Spectrum5_001745, Lopac-M-5250

Molecular Formula:	C₁₃H₁₆N₂O₂	Molecular Weight:	232.278340 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: DRLFMBDRBRZALE-UHFFFAOYSA-N

• Methanol-D

IUPAC Name: deuteriooxymethane | CAS Registry Number: 1455-13-6
Synonyms: methyl alcohol, Methanol-d, Methanol-O-d1, Methan-d-ol, Methan(ol-d), Methyl alcohol-OD, Methan(2H)ol, mono-Deuteromethanol, CH3OD, 151939_ALDRICH, 550574_ALDRICH, DEUTERO METHANOL, CH(3)OD, EINECS 215-933-0, CID123113, 4206-31-9

Molecular Formula:	CH₄O	Molecular Weight:	33.048022 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: OKKJLVBELUTLKV-VMNATFBRSA-N

• Methanol-d4

IUPAC Name: trideuterio(deuteriooxy)methane | CAS Registry Number: 811-98-3
Synonyms: Tetradeuteromethanol, Perdeuteromethanol, (2H4)Methanol, Methanol-12C,d4, Methyl-d3 alcohol d, Methyl-12C-d3 alcohol-d, 151947_ALDRICH, 194166_ALDRICH, 236985_ALDRICH, 269824_ALDRICH, 296775_ALDRICH, 308811_ALDRICH, 343803_ALDRICH, 417653_ALDRICH, 422878_ALDRICH, 423084_ALDRICH, 439029_ALDRICH, 441384_ALDRICH, 444758_ALDRICH, 453315_ALDRICH

Molecular Formula:	CH₄O	Molecular Weight:	36.066507 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: OKKJLVBELUTLKV-MZCSYVLQSA-N

• N,N-Dimethylformamide-D7

IUPAC Name: 1-deuterio-N,N-bis(trideuteriomethyl)formamide | CAS Registry Number: 4472-41-7
Synonyms: Dimethylformamide, Dimethyl formamide-d7, N,N-Dimethylformamide-d7, DMF-d7, 189979_ALDRICH, 269808_ALDRICH, 269905_ALDRICH, 308781_ALDRICH, 441341_ALDRICH, Heptadeutero-N,N-dimethylformamide, N,N-Di(2H3)methyl(2H)formamide, CID78225, EINECS 224-745-8, Formamide-1-d, N,N-di(methyl-d(sub 3))-

Molecular Formula:	C₃H₇NO	Molecular Weight:	80.136912 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: ZMXDDKWLCZADIW-YYWVXINBSA-N

• N-Acetyl-D-alanine

IUPAC Name: (2R)-2-acetamidopropanoic acid | CAS Registry Number: 19436-52-3
Synonyms: N-Acetyl-DL-alanine, A4375_SIGMA, EINECS 243-066-8, FS000602, 1115-69-1

Molecular Formula:	C₅H₉NO₃	Molecular Weight:	131.129860 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: KTHDTJVBEPMMGL-GSVOUGTGSA-N

• N-acetyl-d-glutamic Acid

IUPAC Name: (2R)-2-acetamidopentanedioic acid | CAS Registry Number: 19146-55-5
Synonyms: N-ACETYL-D-GLUTAMIC ACID, (R)-2-Acetamidopentanedioic acid, (2R)-2-acetamidopentanedioic acid, AG-E-39799, 339072-10-5, AC1LTGHH, AC-D-GLU-OH, N-Acetyl-D-glutamic aicd, N-AC-D-GLU-OH, D-Glutamic acid,N-acetyl-, KSC540M6T, CTK4E0669, ANW-50329, AKOS006275139, AKOS015837755, AB02539, AM81691, RP24888, AK-72927, BR-72927

Molecular Formula:	C₇H₁₁NO₅	Molecular Weight:	189.165940 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: RFMMMVDNIPUKGG-RXMQYKEDSA-N

• N-Acetyl-dl-Alanine

IUPAC Name: 2-acetamidopropanoic acid | CAS Registry Number: 1115-69-1
Synonyms: Acetylalanine, N-ACETYLALANINE, N-Acetyl-S-alanine, L-Alanine, N-acetyl-, N-Acetyl-L-alanine, N-Acetyl-DL-alanine, Alanine, N-acetyl-, L-, DL-Alanine, N-acetyl-, 2-acetamidopropanoic acid, 2-Acetamidopropionic acid, 2-Acetylaminopropionic acid, L-Alanine, N-acetyl- (9CI), Alanine, N-acetyl-, L- (8CI), NSC43118, EINECS 202-602-0, EINECS 214-229-0, NSC186892, NSC203819, SBB000064, DB02518

Molecular Formula:	C₅H₉NO₃	Molecular Weight:	131.129860 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: KTHDTJVBEPMMGL-UHFFFAOYSA-N

• N-Acetyl-L-glutamic acid

IUPAC Name: (2S)-2-acetamidopentanedioic acid | CAS Registry Number: 1188-37-0
Synonyms: acetylglutamic acid, N-Acetylglutamate, N-acetyl-L-glutamate, Acetyl glutamic acid, N-acetylglutamic acid, L-N-Acetylglutamic acid, Spectrum_000981, Spectrum2_001349, Spectrum3_001397, Spectrum4_000892, Spectrum5_001040, L-Glutamic acid, N-acetyl-, BSPBio_003014, KBioGR_001324, KBioSS_001461, DivK1c_000406, SPECTRUM1500703, SPBio_001537, 855642_ALDRICH, Glutamic acid, N-acetyl-, L-

Molecular Formula:	C₇H₁₁NO₅	Molecular Weight:	189.165940 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: RFMMMVDNIPUKGG-YFKPBYRVSA-N

• N-Acetylglycine

IUPAC Name: 2-acetamidoacetic acid | CAS Registry Number: 543-24-8
Synonyms: Aceturic acid, Acetamidoacetic acid, Glycine, N-acetyl-, Acetylglycocoll, Acetylglycine, N-ACETYLGLYCINE, Acetylaminoacetic acid, Ethanoylaminoethanoic acid, 2-Acetamidoacetic acid, (acetylamino)acetic acid, 2-acetamido-acetic acid, ACETYLAMINO-ACETIC ACID, A16300_ALDRICH, 01180_FLUKA, NSC7605, AIDS018665, AIDS-018665, CID10972, NSC 7605, EINECS 208-839-6

Molecular Formula:	C₄H₇NO₃	Molecular Weight:	117.103280 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: OKJIRPAQVSHGFK-UHFFFAOYSA-N

• N-Caproic Acid (Hexanoic Acid)

IUPAC Name: hexanoic acid | CAS Registry Number: 142-62-1
Synonyms: Caproic acid, HEXANOIC ACID, n-Caproic acid, Capronic acid, Hexoic acid, n-Hexanoic acid, Butylacetic acid, Pentiformic acid, n-Hexylic acid, n-Hexoic acid, Pentylformic acid, 1-Hexanoic acid, Hexylic acid, Hexanoate, Hexacid 698, Pentanecarboxylic acid, 1-Pentanecarboxylic acid, Hexanoic acid (natural), Acid C-6, Ambap4406

Molecular Formula:	C₆H₁₂O₂	Molecular Weight:	116.158280 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: FUZZWVXGSFPDMH-UHFFFAOYSA-N

• N-Valeric Acid

IUPAC Name: pentanoic acid | CAS Registry Number: 64118-37-2
Synonyms: Valeric acid, PENTANOIC ACID, n-Valeric acid, Valerianic acid, n-Pentanoic acid, 1-Butanecarboxylic acid, 109-52-4, Propylacetic acid, Butanecarboxylic acid, Pentanoate, pentoic acid, n-Pentanoate, VALERIC ACID, N-, Valerate, Valeric acid, normal, Valeriansaeure, Kyselina valerova, Kyselina valerova [Czech], Butane-1-carboxylic acid, UNII-GZK92PJM7B

Molecular Formula:	C₅H₁₀O₂	Molecular Weight:	102.131700 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: NQPDZGIKBAWPEJ-UHFFFAOYSA-N

• O-Diaminobenzene

IUPAC Name: benzene-1,2-diamine | CAS Registry Number: 95-54-5
Synonyms: 1,2-Benzenediamine, O-PHENYLENEDIAMINE, Orthamine, 2-Aminoaniline, o-Benzenediamine, o-Diaminobenzene, 1,2-Diaminobenzene, 1,2-Phenylenediamine, OPDA, PODA, o-Phenylene diamine, benzene-1,2-diamine, 2-Phenylene diamine, 2-aminophenylamine, CI Oxidation Base 16, Phenylenediamine, ortho-, o-Fenylendiamin [Czech], C.I. Oxidation Base 16, phenylene-1,2-dimaine, 1,2-Fenylendiamin [Czech]

Molecular Formula:	C₆H₈N₂	Molecular Weight:	108.141120 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: GEYOCULIXLDCMW-UHFFFAOYSA-N

• Octanoic acid

IUPAC Name: octanoic acid | CAS Registry Number: 124-07-2
Synonyms: octanoic acid, caprylic acid, Octylic acid, n-caprylic acid, octoic acid, n-octanoic acid, n-octylic acid, Enantic acid, capryloate, neo-fat 8, octanoate, Octic acid, 0ctanoic acid, Caprylsaeure, n-Octoic acid, Kaprylsaeure, Octansaeure, C-8 acid, 1-heptanecarboxylic acid, Sodium caprylate

Molecular Formula:	C₈H₁₆O₂	Molecular Weight:	144.211440 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: WWZKQHOCKIZLMA-UHFFFAOYSA-N

• Phthalic acid

IUPAC Name: phthalic acid | CAS Registry Number: 88-99-3
Synonyms: phthalic acid, o-phthalic acid, o-dicarboxybenzene, phthalate, 1,2-benzenedicarboxylic acid, Acide phtalique, p-Phthalic acid, o-benzenedicarboxylic acid, benzene-1,2-dicarboxylic acid, Acide phtalique [French], Kyselina ftalova [Czech], WLN: QVR BVQ, Phthalate standard for IC, CCRIS 1446, Phthalic acid-ring-UL-14C, HSDB 1339, MLS002152931, BENZENEDICARBOXYLIC ACID, 442758_SUPELCO, NSC 5348

Molecular Formula:	C₈H₆O₄	Molecular Weight:	166.130840 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: XNGIFLGASWRNHJ-UHFFFAOYSA-N

• Sodium acetate

IUPAC Name: sodium acetate | CAS Registry Number: 127-09-3
Synonyms: Sodii acetas, Natrium aceticum, Sodium ethanoate, Natriumazetat, Acetic acid, sodium salt, Sodium acetate anhydrous, Anhydrous sodium acetate, Octan sodny [Czech], Caswell No. 741A, Natriumacetat [German], Acetic acid sodium salt, SCFA, FEMA Number 3024, Sodium acetate solution, short chain fatty acids, FEMA No. 3024, HSDB 688, S2889_SIGMA, S3272_SIGMA, S5636_SIGMA

Molecular Formula:	C₂H₃NaO₂	Molecular Weight:	82.033790 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: VMHLLURERBWHNL-UHFFFAOYSA-M

• Sodium Deuteroxide

Synonyms: Sodium deuteroxide, Sodium hydroxide-d, Sodium deuteroxide solution, 164488_ALDRICH, 176788_ALDRICH, 372072_ALDRICH, DE910, Sodium deuteroxide (30% in D2O), Sodium deuteroxide (30% in D2O) >99.5 Atom % D

Molecular Formula:	HNaO	Molecular Weight:	41.003271 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: HEMHJVSKTPXQMS-DYCDLGHISA-M

• Terephthalic acid

IUPAC Name: terephthalic acid | CAS Registry Number: 100-21-0
Synonyms: TEREPHTHALIC ACID, p-Phthalic acid, Terephthalate, Tephthol, p-Dicarboxybenzene, 1,4-Benzenedicarboxylic acid, para-Phthalic acid, Acide terephtalique, Kyselina terftalova, p-Benzenedicarboxylic acid, p-Carboxybenzoic acid, 1,4-dicarboxybenzene, WLN: QVR DVQ, Acide terephtalique [French], Kyselina tereftalova [Czech], TA-33MP, Benzene-p-dicarboxylic acid, benzene-1,4-dicarboxylic acid, CCRIS 2786, HSDB 834

Molecular Formula:	C₈H₆O₄	Molecular Weight:	166.130840 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: KKEYFWRCBNTPAC-UHFFFAOYSA-N

• Tetradecanoic-2,2-D2 acid

IUPAC Name: 2,2-dideuteriotetradecanoic acid | CAS Registry Number: 30719-21-2
Synonyms: TETRADECANOIC-2,2-D2ACID

Molecular Formula:	C₁₄H₂₈O₂	Molecular Weight:	230.383244 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: TUNFSRHWOTWDNC-KLTYLHELSA-N

• Tetrahydrofuran-D8

IUPAC Name: 2,2,3,3,4,4,5,5-octadeuteriooxolane | CAS Registry Number: 1693-74-9
Synonyms: Octadeuterotetrahydrofuran, Deuterated tetrahydrofuran, (2H4)Tetrahydro(2H4)furan, Furan-D4-, tetrahydro-D4-, 184314_ALDRICH, 269891_ALDRICH, 437727_ALDRICH, 441406_ALDRICH, EINECS 216-898-4

Molecular Formula:	C₄H₈O	Molecular Weight:	80.155014 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: WYURNTSHIVDZCO-SVYQBANQSA-N

• Thiobencarb

IUPAC Name: S-[(4-chlorophenyl)methyl] N,N-diethylcarbamothioate | CAS Registry Number: 28249-77-6
Synonyms: Benthiocarb, Bolero, THIOBENCARB, Saturno, Siacarb, Saturn, Saturn (Pesticide), Benthiocarb [ISO], Saturn (herbicide), Caswell No. 207DA, Thiobencarbe [ISO-French], PS1017_SUPELCO, Thiobencarb [ANSI:BSI:ISO], HSDB 6846, S-4-Chlorobenzyl diethylthiocarbamate, 45687_RIEDEL, IMC 3950, EINECS 248-924-5, EPA Pesticide Chemical Code 108401, CID34192

Molecular Formula:	C₁₂H₁₆ClNOS	Molecular Weight:	257.779540 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: QHTQREMOGMZHJV-UHFFFAOYSA-N

• Uracil-5-D

IUPAC Name: 1H-pyrimidine-2,4-dione | CAS Registry Number: 24897-50-5
Synonyms: uracil, Pirod, Pyrod, 2,4-Pyrimidinediol, Hybar X, 2,4(1H,3H)-Pyrimidinedione, 2,4-Dihydroxypyrimidine, 2,4-Dioxopyrimidine, 2,4-Pyrimidinedione, Urazil, pyrimidine-2,4-diol, Uracil [USAN], Uracil-5-d, Uracil (8CI), Uracil-2-14C, 1ui0, Uracil (JAN/USAN), 1H-Pyrimidine-2,4-dione, CCRIS 3077, bmse000187

Molecular Formula:	C₄H₄N₂O₂	Molecular Weight:	112.086760 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: ISAKRJDGNUQOIC-UHFFFAOYSA-N

• Ursodeoxycholic-2,2,4,4-D4 acid

IUPAC Name: (4R)-4-[(3R,5R,7S,8R,9S,10S,13R,17R)-2,2,4,4-tetradeuterio-3,7-dihydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid | CAS Registry Number: 347841-46-7
Synonyms: [2H4]-Ursodiol, [2H4]-Ursodeoxycholic Acid

Molecular Formula:	C₂₄H₄₀O₄	Molecular Weight:	396.596647 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: RUDATBOHQWOJDD-RADQSFQKSA-N

• Ursodeoxycholic-24-13C acid

IUPAC Name: (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid | CAS Registry Number: 63296-46-8
Synonyms: [13C]-Ursudiol, [13C]- Ursodeoxycholic Acid

Molecular Formula:	C₂₄H₄₀O₄	Molecular Weight:	393.564655 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: RUDATBOHQWOJDD-GFKJCODUSA-N

• 7beta-Hydroxycholesterol-25,26,26,26-27,27,27-D7

IUPAC Name: (3S,7R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-5,6,6,6-tetradeuterio-5-(trideuteriomethyl)hexan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol | CAS Registry Number: 349553-97-5

Molecular Formula:	C₂₆H₄₄O₂	Molecular Weight:	395.679 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: HKTLZNPSEKWWSW-KXSSCKPSSA-N

• 2-Chloronaphthalene-D7

IUPAC Name: 2-chloro-1,3,4,5,6,7,8-heptadeuterionaphthalene | CAS Registry Number: 93951-84-9
Synonyms: 2-Chloronaphthalene-d7

Molecular Formula:	C₁₀H₇Cl	Molecular Weight:	169.659 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: CGYGETOMCSJHJU-GSNKEKJESA-N

• 4-Hydroxy-3-(methoxy-D3)mandelic acid

IUPAC Name: 2-hydroxy-2-[4-hydroxy-3-(trideuteriomethoxy)phenyl]acetic acid | CAS Registry Number: 74495-70-8
Synonyms: Vanilinmandelic Acid-d3, HMMA-d3, VMA-d3, dl-Vanillomandelic Acid-d3, (+/-)-Vanilmandelic Acid-d3, CTK8F6020, 4-Hydroxy-3-methoxymandelic Acid-d3, AG-G-96168, 4-Hydroxy-3-(methoxy-d3)-mandelic Acid, 4-Hydroxy-3-(methoxy-D3)mandelic acid;, FT-0669753, [4-Hydroxy-3-(methoxy-d3)phenyl]glycolic Acid, |A,4-Dihydroxy-3-(methoxy-d3)benzeneacetic Acid, 3-(Methoxy-d3)-4-hydroxyphenylhydroxyacetic Acid

Molecular Formula:	C₉H₁₀O₅	Molecular Weight:	201.191185 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: CGQCWMIAEPEHNQ-FIBGUPNXSA-N

• 17-Estradiol-16,16,17-D3

IUPAC Name: (8R,9S,13S,14S,17S)-16,16,17-trideuterio-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthrene-3,17-diol | CAS Registry Number: 79037-37-9
Synonyms: 17beta-Estradiol-16,16,17-d3, Estraderm-d3, 17|A-Estradiol-16,16,17-d3, Estradot-d3, Estrofem-d3, Estrogel-d3, Estrace-d3, Estring-d3, Cimara-d3, Evorel-d3, (17|A)-Estra-1,3,5(10)-triene-3,17-diol-d3, Deuterated 17|A-estradiol, 491187_ALDRICH, CTK8F3224, 3,17-Epidihydroxyestratriene-d3, Dihydrofolliculin-16,16,17-d3, |A-Estradiol-16,16,17-d3, AKOS015913117, AG-L-63171, FT-0668015

Molecular Formula:	C₁₈H₂₄O₂	Molecular Weight:	275.400445 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: VOXZDWNPVJITMN-SPGJGCHISA-N

• 1,2-Dichlorobenzene-D4

IUPAC Name: 1,2-dichloro-3,4,5,6-tetradeuteriobenzene | CAS Registry Number: 2199-69-1
Synonyms: o-Dichloro(2H4)benzene, 331511_ALDRICH, 442226_SUPELCO, Tetradeutero-1,2-dichlorobenzene, EINECS 218-606-0, Benzene-1,2,3,4-D4-, 5,6-dichloro-

Molecular Formula:	C₆H₄Cl₂	Molecular Weight:	151.026607 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: RFFLAFLAYFXFSW-RHQRLBAQSA-N

• 1-Bromoheptane-D15

IUPAC Name: 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecadeuterioheptane | CAS Registry Number: 98195-42-7
Synonyms: 1-BROMOHEPTANE-D15

Molecular Formula:	C₇H₁₅Br	Molecular Weight:	194.190427 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: LSXKDWGTSHCFPP-PMELWRBQSA-N

• (+/-)-Nicotine-Methyl-D3

IUPAC Name: 3-[1-(trideuteriomethyl)pyrrolidin-2-yl]pyridine | CAS Registry Number: 69980-24-1
Synonyms: DL-Nicotine-d3, (R,S)-Nicotine-d3, ( inverted exclamation markA)-Nicotine-d3, rac-Nicotine-d3, DL-Nicotine-methyl-d3, DL-Nicotine-methyl-d3;, DL-Nicotine-(methyl-d3), (+/-)-Nicotine-methyl-d3, DL-Nicotine-d3 (methyl-d3), 489077_ALDRICH, CTK8F1506, AG-G-73072, 3-[1-(Methyl-d3)-2-pyrrolidinyl]pyridine, FT-0604478, ( inverted exclamation markA)-3-[1-(Methyl-d3)-2-pyrrolidinyl)pyridine

Molecular Formula:	C₁₀H₁₄N₂	Molecular Weight:	165.250045 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: SNICXCGAKADSCV-FIBGUPNXSA-N

• 1,5-Diaminopentane

IUPAC Name: pentane-1,5-diamine | CAS Registry Number: 462-94-2
Synonyms: cadaverine, 1,5-pentanediamine, pentamethylenediamine, Cadaverin, Animal coniine, Pentane-1,5-diamine, 1,5-Pentamethylenediamine, BioDex 1-, 1,5-Amylene diamine, 1,5-Diamino-n-pentane, alpha,omega-Pentanediamine, D22606_ALDRICH, CID273, CHEBI:18127, EINECS 207-329-0, AI3-26937, BRN 1697256, DB03854, NCGC00166285-01, LS-101555

Molecular Formula:	C₅H₁₄N₂	Molecular Weight:	102.178060 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: VHRGRCVQAFMJIZ-UHFFFAOYSA-N

• 1,2-Benzanthracene

IUPAC Name: benzo[a]anthracene | CAS Registry Number: 56-55-3
Synonyms: Benzanthracene, Benz[a]anthracene, Tetraphene, Naphthanthracene, Benzanthrene, Benzoanthracene, Benzo(a)anthracene, 1,2-Benzanthrene, 2,3-Benzphenanthrene, Benzo(b)phenanthrene, Benzo[a]anthracene, 1,2-Benzoanthracene, 1,2-Benzanthrazen, BENZ(A)ANTHRACENE, 2,3-Benzophenanthrene, Benzo[a]phenanthrene, Benzo[b]phenanthrene, Ambap123, 1,2-Benz(a)anthracene, RCRA waste no. U018

Molecular Formula:	C₁₈H₁₂	Molecular Weight:	228.287880 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: DXBHBZVCASKNBY-UHFFFAOYSA-N