AG003ILX

34893-92-0 | 3,5-Dichlorophenyl isocyanate

AG003ILX

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CAS Number	34893-92-0
Catalog Number	AG003ILX(AGN-PC-0JM0P3)
Chemical Name	3,5-Dichlorophenyl isocyanate
EC Number	252-276-9
IUPAC Name	1,3-dichloro-5-isocyanatobenzene
InChI	InChI=1S/C7H3Cl2NO/c8-5-1-6(9)3-7(2-5)10-4-11/h1-3H
InChI Key	XEFUJGURFLOFAN-UHFFFAOYSA-N
MDL Number	MFCD00013859
Molecular Formula	C7H3Cl2NO
Molecular Weight	188.0108
SMILES	ClC1=CC(Cl)=CC(N=C=O)=C1
Synonyms	3,5-Dichlorophenyl isocyanate, 34893-92-0, 1,3-Dichloro-5-isocyanatobenzene, 3,5-Dichlorophenylisocyanate, Benzene, 1,3-dichloro-5-isocyanato-, 3,5-Dichlorophenyl isocyantae, 3,5-Dichlorophenylisocyantae, XEFUJGURFLOFAN-UHFFFAOYSA-N, 1,3-Dichloro-5-isocyanato-benzene, 3,5-Dichlorophenyl isocyanate, 96%, MFCD00013859, 3,5-dichlorobenzenisocyanate, EINECS 252-276-9, AC1Q3HZQ, AC1Q3LIC, EC 252-276-9, AC1L3S9L, 3,5dichlorophenyl isocyanate, ACMC-1AI47, SCHEMBL93410, KSC490C1L, 3,5-dichloro-phenylisocyanate, 3,5-dichlorophenyl-isocyanate, 3, 5-dichlorophenyl isocyanate, 3,5-dichloro-phenyl isocyanate, Jsp006309, DTXSID2067878, CTK3J0115, ZINC164665, 1,3-dichloro-5-iso-cyanatobenzene, ACT02983, ALBB-021387, 1,3-Dichloro-5-isocyanatobenzene #, ANW-28007, GEO-01007, I5D151, SBB064238, AKOS000173292, MCULE-2261883512, NE10743, RTR-014415, VZ25742, KS-0000107U, TRA-0184333, Isocyanic Acid 3,5-Dichlorophenyl Ester, CJ-02201, R843, SC-16580, ZB008251, DB-022042, TR-014415, A6129, FT-0614565, I0302, ST50825279, I01-4421, W-106701, C7H3Cl2NO, C7-H3-Cl2-N-O, KST-1B3558, CID94460, AR-1B6869, ZINC00164665, 3,5-Dichlorophenyl isocyanate, 97% 5g, 3,5-Dichlorophenyl isocyanate, 96% - 1G 1g, 35967-02-3,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	186.959g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	188.007g/mol
Monoisotopic Mass	186.959g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	29.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301+H311+H331-H315-H319-H335
Packing Group	Ⅱ
Precautionary statements	P261-P280-P301+P310-P305+P351+P338-P311
UN Code	UN 2206

Certificate of Analysis

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