AG003E82

706-07-0 | 1-Chloro-4-(2-nitrovinyl)benzene

AG003E82

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CAS Number	706-07-0
Catalog Number	AG003E82(AGN-PC-0077T7)
Chemical Name	1-Chloro-4-(2-nitrovinyl)benzene
IUPAC Name	1-chloro-4-[(E)-2-nitroethenyl]benzene
InChI	InChI=1S/C8H6ClNO2/c9-8-3-1-7(2-4-8)5-6-10(11)12/h1-6H/b6-5+
InChI Key	GLJATYFHELDGEA-AATRIKPKSA-N
MDL Number	MFCD00024825
Molecular Formula	C8H6ClNO2
Molecular Weight	183.5917
NSC Number	2547
SMILES	O=[N+](/C=C/C1=CC=C(Cl)C=C1)[O-]
Synonyms	1-(4-chlorophenyl)-2-nitroethene, 706-07-0, 1-chloro-4-(2-nitrovinyl)benzene, p-Chloro-beta-nitro-styrene, 1-Chloro-4-(2-nitro-vinyl)-benzene, Styrene, p-chloro-beta-nitro-, Benzene, 1-chloro-4-(2-nitroethenyl)-, 5153-70-8, trans-4-Chloro-beta-nitrostyrene, 1-Chloro-4-[(E)-2-nitroethenyl]benzene, Styrene, p-chloro-.beta.-nitro-, NSC 2547, p-Cloro-beta-nitrostirene [Italian], (E)-1-chloro-4-(2-nitrovinyl)benzene, BRN 2208373, p-Chloro-.beta.-nitrostyrene, 4-Chloro-.beta.-nitrostyrene, 4-Chloro-beta-nitrostyrene, GLJATYFHELDGEA-AATRIKPKSA-N, 1-chloro-4-[(E)-2-nitrovinyl]benzene, 1-((1E)-2-nitrovinyl)-4-chlorobenzene, Benzene, 1-chloro-4-[(E)-2-nitroethenyl]-, 1-chloro-4-((E)-2-nitrovinyl)benzene, p-Cloro-beta-nitrostirene, NSC2547, 4-chloro B-nitrostyrene, beta-Nitro-4-chlorostyrene, 4'-chloro-beta-nitrostyrene, p-Cloro-.beta.-nitrostirene, 3-05-00-01181 (Beilstein Handbook Reference), SCHEMBL219463, AC1NS534, AC1Q3N35, CHEMBL230690, (E)-4-Chloro-beta-nitrostyrene, HMS561B10, ZINC97583, 1-(2-Nitrovinyl)-4-chlorobenzene, ALBB-023325, NSC-2547, ANM102893, CX1346, MFCD00024825, AKOS001274725, AKOS017278253, QC-3895, trans-4-Chloro-beta-nitrostyrene, 97%, NCGC00340559-01, AJ-11043, AS-19347, ZB003423, 1-chloro-4-((E)-2-nitro-vinyl)-benzene, AB0033529, LS-147213, TC-146134, TR-023356, 1-Chloro-4-[(E)-2-nitroethenyl]benzene #, R1529, ST24037942, ST45024083, TL80073662, X7123, AB01122699-03, AB01122699-04, Benzene, 1-chloro-4-(2-nitroethenyl)- (9CI), 706C070, I01-14247, C8H6ClNO2, 1- -2-NITROETHENE, C8-H6-Cl-N-O2, 1-chloro-4-(2-nitroethenyl)benzene, AR-1C2380, CB10126, CID5354182, Styrene,p-chloro-.beta.-nitro-,(E)-, 7291-41-0,

Complexity	180
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	183.009g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	183.591g/mol
Monoisotopic Mass	183.009g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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