AG009GGZ

133541-45-4 | 4-Bromo-2,5-difluorobenzonitrile

AG009GGZ

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CAS Number	133541-45-4
Catalog Number	AG009GGZ(AGN-PC-003768)
Chemical Name	4-Bromo-2,5-difluorobenzonitrile
IUPAC Name	4-bromo-2,5-difluorobenzonitrile
InChI	InChI=1S/C7H2BrF2N/c8-5-2-6(9)4(3-11)1-7(5)10/h1-2H
InChI Key	YIEQHIRFLYNDKP-UHFFFAOYSA-N
MDL Number	MFCD11847049
Molecular Formula	C7H2BrF2N
Molecular Weight	217.9983
SMILES	N#CC1=CC(F)=C(Br)C=C1F
Synonyms	4-Bromo-2,5-difluorobenzonitrile, 133541-45-4, Benzonitrile, 4-bromo-2,5-difluoro-, AK-58096, SCHEMBL1630792, CTK8B7122, KS-00000OKM, DTXSID30566548, YIEQHIRFLYNDKP-UHFFFAOYSA-N, ANW-56436, MFCD11847049, ZINC34419669, AKOS016004819, AS06916, CS-W005705, FCH1406404, MP-0731, PC49639, AC-28614, AJ-88454, AS-20035, BBV-40282511, CJ-18364, DA-16616, SC-14370, AB0061097, AX8211284, TC-145181, 4CH-000243, FT-0746964, ST24028924, Z4095, EN300-124068, C7H2BrF2N, ACN-052108,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.934g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	218.001g/mol
Monoisotopic Mass	216.934g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	23.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number