AG00HTF4

1346555-56-3 | 4-Bromo-3-fluoro-2H-pyrazole

AG00HTF4

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CAS Number	1346555-56-3
Catalog Number	AG00HTF4(AGN-PC-0WBRAR)
Chemical Name	4-Bromo-3-fluoro-2H-pyrazole
IUPAC Name	4-bromo-5-fluoro-1H-pyrazole
InChI	InChI=1S/C3H2BrFN2/c4-2-1-6-7-3(2)5/h1H,(H,6,7)
InChI Key	DSMSQFNGAMOGCW-UHFFFAOYSA-N
MDL Number	MFCD28517446
Molecular Formula	C3H2BrFN2
Molecular Weight	164.9638
SMILES	FC1=NNC=C1Br
Synonyms	4-bromo-3-fluoro-1H-pyrazole, 1346555-56-3, 4-bromo-5-fluoro-1H-pyrazole, SCHEMBL20637735, MFCD28517446, AKOS024052975, AKOS024052977, ZINC212201581, 4-BROMO-3-FLUORO-2H-PYRAZOLE, AS-52600, CS-0050990, KS-00000871,

Complexity	70
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	163.939g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.965g/mol
Monoisotopic Mass	163.939g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	28.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
UN Code	\N

Certificate of Analysis

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