AG00HFXG

1211515-50-2 | 2-Bromopyrimidine-4-carboxylic acid

AG00HFXG

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CAS Number	1211515-50-2
Catalog Number	AG00HFXG(AGN-PC-0WANAF)
Chemical Name	2-Bromopyrimidine-4-carboxylic acid
IUPAC Name	2-bromopyrimidine-4-carboxylic acid
InChI	InChI=1S/C5H3BrN2O2/c6-5-7-2-1-3(8-5)4(9)10/h1-2H,(H,9,10)
InChI Key	BXVZKCRMRSEGES-UHFFFAOYSA-N
MDL Number	MFCD27923789
Molecular Formula	C5H3BrN2O2
Molecular Weight	202.9935
SMILES	O=C(C1=NC(Br)=NC=C1)O
Synonyms	2-Bromopyrimidine-4-carboxylic acid, 1211515-50-2, SCHEMBL19128939, MFCD27923789, ZINC95930682, AKOS022178415, DS-8432, FCH2491625, AK145986, AJ-136527, AX8283759, CS-0060693,

Complexity	142
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	201.938g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	202.995g/mol
Monoisotopic Mass	201.938g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	63.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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