AG003RPW

13532-18-8 | Methyl 3-(methylthio)propionate

AG003RPW

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CAS Number	13532-18-8
Catalog Number	AG003RPW(AGN-PC-03DBYI)
Chemical Name	Methyl 3-(methylthio)propionate
EC Number	236-883-6
FEMA Number	2720
IUPAC Name	methyl 3-methylsulfanylpropanoate
InChI	InChI=1S/C5H10O2S/c1-7-5(6)3-4-8-2/h3-4H2,1-2H3
InChI Key	DMMJVMYCBULSIS-UHFFFAOYSA-N
MDL Number	MFCD00008565
Molecular Formula	C5H10O2S
Molecular Weight	134.1967
NSC Number	76415
SMILES	O=C(OC)CCSC
UNII	28913SS9T9
Synonyms	Methyl 3-(methylthio)propionate, 13532-18-8, Methyl 3-(methylthio)propanoate, Methyl 3-methylthiopropionate, Propanoic acid, 3-(methylthio)-, methyl ester, Methyl beta-methiopropionate, Methyl-3-(methylthio)propionate, methyl 3-methylsulfanylpropanoate, Methyl 3-(methylsulfanyl)propanoate, methyl 3-methylthiopropanoate, Propionic acid, 3-(methylthio)-, methyl ester, Methyl beta-methylthiopropionate, UNII-28913SS9T9, 3-(Methylthio)propanoic acid methyl ester, Methyl beta-methylmercaptopropionate, Methyl 3-(methylmercapto)propionate, NSC 76415, Methyl-3-methylmercaptopropionate, Methyl .beta.-methylthiopropionate, MFCD00008565, Methyl .beta.-methylmercaptopropionate, METHYL3-(METHYLTHIO)PROPIONATE, 28913SS9T9, Methyl ester of 3-(methylthio)propanoic acid, Propionic acid, 3-(methylthio)-, methyl ester (8CI), Methyl 3-(methylthio)propionate, 99+%, FEMA No. 2720, EINECS 236-883-6, AI3-36712, Methyl methylthiopropanoate, 3-(methylsulfanyl)propionic acid methyl ester, AC1L1VN5, KSC492S9P, SCHEMBL857398, methyl-3-methyl thiopropionate, ACMC-209c04, Methyl-3-Methylthio Propionate, CHEMBL119603, Jsp002144, DTXSID0047402, CTK3J2997, DMMJVMYCBULSIS-UHFFFAOYSA-, FEMA 2720, Methyl beta -methylthiopropionate, DMMJVMYCBULSIS-UHFFFAOYSA-N, methyl 3-(methyl thio) propionate, KS-00000Z6V, NSC76415, ZINC1707856, Methyl beta -methylmercaptopropionate, 2-Methoxycarbonylethyl methyl sulfide, ANW-19826, NSC-76415, AKOS008902908, MCULE-8525618169, Methyl 3-(methylthio)propionate, 98%, AN-18451, CJ-06761, CJ-28916, 3-(Methylthio)propionic Acid Methyl Ester, RT-001186, 3-Methylsulfanyl-propionic acid methyl ester, FT-0613800, M0862, ST51037875, Propanoic acid,3-(methylthio)-, methyl ester, Methyl 3-(methylthio)propionate, >=98%, FG, J-640412, J-800446, Q-100134, InChI=1/C5H10O2S/c1-7-5(6)3-4-8-2/h3-4H2,1-2H3, n-butyl 2-methylbutyrate, Propanoic acid, methyl ester, Propionic acid, methyl ester, C5H10O2S, C5-H10-O2-S, CID61641, 1-[2-(Dimethylamino)ethyl]-1H-tetrazole-5-thiol, Methyl 3-(methylthio)propionate, 98% - 100G 100g,

Complexity	72.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	134.04g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	134.193g/mol
Monoisotopic Mass	134.04g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	51.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H227
Packing Group	Ⅲ
Precautionary statements	P210-P280-P501
UN Code	UN 1993

Certificate of Analysis

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