AG00221E

1805029-24-6 | Benzene, 1-chloro-2,5-difluoro-3-nitro-

AG00221E

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CAS Number	1805029-24-6
Catalog Number	AG00221E(AGN-PC-0WD4DH)
Chemical Name	Benzene, 1-chloro-2,5-difluoro-3-nitro-
IUPAC Name	1-chloro-2,5-difluoro-3-nitrobenzene
InChI	InChI=1S/C6H2ClF2NO2/c7-4-1-3(8)2-5(6(4)9)10(11)12/h1-2H
InChI Key	KEZVSFPNJJNPHU-UHFFFAOYSA-N
MDL Number	MFCD27923474
Molecular Formula	C6H2ClF2NO2
Molecular Weight	193.5354
SMILES	O=[N+](C1=C(F)C(Cl)=CC(F)=C1)[O-]
Synonyms	1-Chloro-2,5-difluoro-3-nitrobenzene, 1805029-24-6, SCHEMBL9847876, KS-00000S1Z, 5-Methanesulfonyl-pyridin-3-ylamine, MFCD27923474, ZINC95930271, AKOS022176631, DS-7975, FCH2496696, AK144905, AJ-136176, AX8329219, Benzene, 1-chloro-2,5-difluoro-3-nitro-,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.974g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	193.534g/mol
Monoisotopic Mass	192.974g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

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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