AG003RP5

6376-59-6 | Methyl 2-oxopentanoate

AG003RP5

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CAS Number	6376-59-6
Catalog Number	AG003RP5(AGN-PC-0A2EH4)
Chemical Name	Methyl 2-oxopentanoate
IUPAC Name	methyl 2-oxopentanoate
InChI	InChI=1S/C6H10O3/c1-3-4-5(7)6(8)9-2/h3-4H2,1-2H3
InChI Key	MBNLVYPIKSWXCT-UHFFFAOYSA-N
MDL Number	MFCD10566912
Molecular Formula	C6H10O3
Molecular Weight	130.1418
SMILES	CCCC(C(OC)=O)=O
Synonyms	methyl 2-oxopentanoate, Methyl 2-Oxovalerate, 6376-59-6, methyl-2-oxopentanoate, pentanoic acid, 2-oxo-, methyl ester, 2-Oxovaleric Acid Methyl Ester, 2-Oxopentanoic Acid Methyl Ester, MBNLVYPIKSWXCT-UHFFFAOYSA-N, Methyl2-Oxovalerate, ACMC-209nhz, AC1LD4M7, SCHEMBL992042, 2-Oxovaleric acid, methyl ester, DTXSID40349001, 2-oxo-pentanoic acid methyl ester, KS-000014JR, ANW-34725, MFCD10566912, ZINC14619948, AKOS015855344, AJ-65031, TR-021927, M1863, I14-107092, InChI=1/C6H10O3/c1-3-4-5(7)6(8)9-2/h3-4H2,1-2H, CID642256,

Complexity	118
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	130.063g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	130.143g/mol
Monoisotopic Mass	130.063g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H225-H331
Packing Group	Ⅱ
Precautionary statements	P280-P311
UN Code	UN 1993

Certificate of Analysis

Lot Number