AG008QOG

7425-63-0 | Methyl 3-bromo-2-oxopropanoate

AG008QOG

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CAS Number	7425-63-0
Catalog Number	AG008QOG(AGN-PC-0JQACZ)
Chemical Name	Methyl 3-bromo-2-oxopropanoate
IUPAC Name	methyl 3-bromo-2-oxopropanoate
InChI	InChI=1S/C4H5BrO3/c1-8-4(7)3(6)2-5/h2H2,1H3
InChI Key	MQONVZMIFQQQHA-UHFFFAOYSA-N
MDL Number	MFCD01862963
Molecular Formula	C4H5BrO3
Molecular Weight	180.9847
NSC Number	526776
SMILES	O=C(OC)C(CBr)=O
Synonyms	Methyl bromopyruvate, methyl 3-bromo-2-oxopropanoate, 7425-63-0, Methyl 3-bromopyruvate, 3-bromo-2-oxopropanoic acid methyl ester, Propanoic acid, 3-bromo-2-oxo-, methyl ester, NSC526776, BrCH2COCO2Me, methyl-3-bromopyruvate, ACMC-1BFCL, AC1L70JU, SCHEMBL247679, Methyl bromopyruvate, technical, methyl 3-bromo-2-oxopropionate, CTK3J8060, 3-Bromopyruvic Acid Methyl Ester, DTXSID00326318, MQONVZMIFQQQHA-UHFFFAOYSA-N, KS-00000JO6, ZINC1606708, ANW-52522, MFCD01862963, AKOS015949584, CS-W008779, E2726G5, NSC-526776, RP08223, RTR-023995, 2-Oxo-3-bromopropionic acid methyl ester, 3-bromo-2-oxopropionic acid methyl ester, AJ-28153, AK-87031, BC208895, S720, SC-15244, AB0018742, DB-074806, TR-023995, FT-0685398, M2223, methyl 3-bromanyl-2-oxidanylidene-propanoate, ST24025279, A838075, J-522593, MethylBromopyruvate, C4H5BrO3, CID352524, ACN-050682,

Complexity	110
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.942g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	180.985g/mol
Monoisotopic Mass	179.942g/mol
Rotatable Bond Count	3
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
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number