AG006H89

932-65-0 | 4-Bromo-1H-pyrazole-3-carboxamide

AG006H89

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CAS Number	932-65-0
Catalog Number	AG006H89(AGN-PC-0W2TDL)
Chemical Name	4-Bromo-1H-pyrazole-3-carboxamide
IUPAC Name	4-bromo-1H-pyrazole-5-carboxamide
InChI	InChI=1S/C4H4BrN3O/c5-2-1-7-8-3(2)4(6)9/h1H,(H2,6,9)(H,7,8)
InChI Key	OVJPKNPBZYQCTR-UHFFFAOYSA-N
MDL Number	MFCD00076865
Molecular Formula	C4H4BrN3O
Molecular Weight	189.9981
SMILES	BrC1=C[NH]N=C1C(=O)N
Synonyms	4-BROMO-1H-PYRAZOLE-3-CARBOXAMIDE, 932-65-0, 4-bromo-1H-pyrazole-5-carboxamide, 1146951-57-6, AK-39986, SCHEMBL2385331, CTK5H2244, KS-00000OEW, DTXSID80634786, OVJPKNPBZYQCTR-UHFFFAOYSA-N, 4-bromo-2H-pyrazole-3-carboxamide, ALBB-013426, BCP23487, ANW-50123, MFCD19443368, ZINC47218751, 1H-pyrazole-5-carboxamide, 4-bromo-, AKOS005174132, AKOS015834370, DS-1045, FCH1411264, FS-3131, RP24849, BR-39986, CJ-20587, QC-10379, AB0027731, AJ-110838, AX8209090, TR-029216, 4CH-010138, FT-0687723, ST24028912, W9599, S-5187, J-514549, C4H4BrN3O,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.954g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	190g/mol
Monoisotopic Mass	188.954g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	71.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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