AG003PLR

868-26-8 | Dimethyl 2-bromomalonate

AG003PLR

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CAS Number	868-26-8
Catalog Number	AG003PLR(AGN-PC-0JL9GO)
Chemical Name	Dimethyl 2-bromomalonate
EC Number	212-775-4
IUPAC Name	dimethyl 2-bromopropanedioate
InChI	InChI=1S/C5H7BrO4/c1-9-4(7)3(6)5(8)10-2/h3H,1-2H3
InChI Key	NEMOJKROKMMQBQ-UHFFFAOYSA-N
MDL Number	MFCD00025865
Molecular Formula	C5H7BrO4
Molecular Weight	211.0107
NSC Number	175888
SMILES	O=C(OC)C(Br)C(OC)=O
Synonyms	Dimethyl bromomalonate, 868-26-8, Dimethyl 2-bromomalonate, DIMETHYLBROMOMALONATE, Propanedioic acid, bromo-, dimethyl ester, 2-Bromo dimethyl malonate, dimethyl 2-bromopropanedioate, NEMOJKROKMMQBQ-UHFFFAOYSA-N, J-640358, Dimethyl bromomalonate, 90%, tech., C5H7BrO4, EINECS 212-775-4, dimethylbromomalo-nate, ACMC-209qbk, dimethyl-2-bromomalonate, AC1L2DBQ, Dimethyl 2-bromomalonate #, SCHEMBL690839, AC1Q244I, Bromomalonic Acid Dimethyl Ester, CTK3F0188, DTXSID60235811, 1,3-dimethyl 2-bromopropanedioate, 2-Bromomalonic acid dimethyl ester, KS-00000XF6, ZINC1720460, 7369AF, ANW-38382, MFCD00025865, NSC175888, AKOS015900202, AM81029, FCH1320031, NSC-175888, CJ-29212, BB0258966, DB-056955, TC-127127, BB 0258966, D3887, FT-0625038, Dimethyl bromomalonate, technical grade, 90%, C-10936, Propanedioic acid, 2-bromo-, 1,3-dimethyl ester, J-800362, I14-10202, F0001-2156, C5-H7-Br-O4, CID70087, AR-1I5642, ACN-050679, (S)-(-)-1,2-EPOXY-5-HEXENE, 93041-76-0,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	209.953g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	211.011g/mol
Monoisotopic Mass	209.953g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅱ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 3265

Certificate of Analysis

Lot Number