AG00301X

30414-53-0 | Pentanoic acid, 3-oxo-, methyl ester

AG00301X

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CAS Number	30414-53-0
Catalog Number	AG00301X(AGN-PC-0BXAEA)
Chemical Name	Pentanoic acid, 3-oxo-, methyl ester
EC Number	250-184-3
IUPAC Name	methyl 3-oxopentanoate
InChI	InChI=1S/C6H10O3/c1-3-5(7)4-6(8)9-2/h3-4H2,1-2H3
InChI Key	XJMIXEAZMCTAGH-UHFFFAOYSA-N
MDL Number	MFCD00011705
Molecular Formula	C6H10O3
Molecular Weight	130.1418
SMILES	CCC(=O)CC(=O)OC
Synonyms	Methyl 3-oxopentanoate, Methyl 3-oxovalerate, 30414-53-0, Methyl propionylacetate, Methyl 3-Oxo-Pentanoate, Pentanoic acid, 3-oxo-, methyl ester, Methyl 3-oxo-n-valerate, MFCD00011705, Valeric acid, 3-oxo-, methyl ester, 3-Oxovaleric Acid Methyl Ester, 3-oxo-pentanoic acid methyl ester, XJMIXEAZMCTAGH-UHFFFAOYSA-N, 3-keto-n-valeric acid methyl ester, Methyl-3-oxo pentanoate, Methyl 3-oxo-pentanoate, 99+%, Methyl3-oxovalerate, EINECS 250-184-3, methyl-3-oxovalerate, methyl 3-ketovalerate, methyl 3-oxo-valerate, methyl-3-oxopentanoate, methyl 3-ketopentanoate, methyl-3-ketopentanoate, PubChem18684, ACMC-1AGMV, methyl-3-oxo-pentanoate, 3-Oxo-methyl pentanoate, AC1Q5GYH, 3-oxopentansauremethylester, Methyl .beta.-ketovalerate, EC 250-184-3, AC1L3T8M, SCHEMBL4604, 3-oxovaleric acid methylester, KSC489S2P, Jsp005738, 3-Ketovaleric Acid Methyl Ester, 3-oxopentanoic acid methyl ester, CTK3I9927, KS-00000BGC, XJMIXEAZMCTAGH-UHFFFAOYSA-, DTXSID40184499, Propionylacetic Acid Methyl Ester, 3-oxopentanoic acid, methyl ester, ZINC391839, ACT03020, ANW-26865, STL185597, AKOS000120601, GS-3030, MCULE-1605349915, RP19903, RTR-013072, TRA0039201, AJ-21132, AK-53853, BC651002, BR-53853, CJ-03520, SC-13642, SY007180, ZB012072, AB0011178, ST2413374, TR-013072, FT-0615941, K0035, C-4385, MFCD00011705 (97+%), I14-1015, W-106944, F0001-0934, InChI=1/C6H10O3/c1-3-5(7)4-6(8)9-2/h3-4H2,1-2H3, C6H10O3, AR-1J5212, C6-H10-O3, CID121699, CS-O-32027, Methyl 3-oxovalerate, 98.5% - 100ML 100ml, 31602-11-6,

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	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H227-H315-H319-H335
Precuationary statements	P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number