AG00CE8X

27258-15-7 | 1H-Pyrazole, 3-broMo-4-iodo-

AG00CE8X

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CAS Number	27258-15-7
Catalog Number	AG00CE8X(AGN-PC-0WBOLB)
Chemical Name	1H-Pyrazole, 3-broMo-4-iodo-
IUPAC Name	5-bromo-4-iodo-1H-pyrazole
InChI	InChI=1S/C3H2BrIN2/c4-3-2(5)1-6-7-3/h1H,(H,6,7)
InChI Key	GCXJYBLZNXJFHY-UHFFFAOYSA-N
MDL Number	MFCD27988092
Molecular Formula	C3H2BrIN2
Molecular Weight	272.8698
SMILES	Ic1c(Br)n[nH]c1
Synonyms	3-bromo-4-iodo-1H-pyrazole, 27258-15-7, 5-Bromo-4-iodo-1H-pyrazole, 3-Bromo-4-iodopyrazole, 1H-Pyrazole, 3-broMo-4-iodo-, MFCD27988092, AKOS025290759, ZINC230504596, FCH2516282, SB21889, KS-0000088I, 3-Bromo-4-iodo-1H-pyrazole, AldrichCPR, AK170524, AS-34884, OR307261, SY044788, CS-0051473, MFCD27988092 (95%), N/A,

Complexity	70
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	271.845g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	272.871g/mol
Monoisotopic Mass	271.845g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	28.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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