AG0033OF

2909-38-8 | 3-Chlorophenyl isocyanate

AG0033OF

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CAS Number	2909-38-8
Catalog Number	AG0033OF(AGN-PC-0JKDSF)
Chemical Name	3-Chlorophenyl isocyanate
EC Number	220-822-5
IUPAC Name	1-chloro-3-isocyanatobenzene
InChI	InChI=1S/C7H4ClNO/c8-6-2-1-3-7(4-6)9-5-10/h1-4H
InChI Key	HHIRBXHEYVDUAM-UHFFFAOYSA-N
MDL Number	MFCD00002016
Molecular Formula	C7H4ClNO
Molecular Weight	153.5658
NSC Number	76588
SMILES	ClC=1C=C(C=CC1)N=C=O
UNII	Y54698FM83
Synonyms	3-CHLOROPHENYL ISOCYANATE, 2909-38-8, 1-Chloro-3-isocyanatobenzene, m-Chlorophenyl isocyanate, Benzene, 1-chloro-3-isocyanato-, 3-Chlorophenylisocyanate, 3-Chloroisocyanatobenzene, Isocyanic acid, m-chlorophenyl ester, m-Chlorfenylisokyanat, Isocyanic Acid 3-Chlorophenyl Ester, m-Chlorfenylisokyanat [Czech], UNII-Y54698FM83, EINECS 220-822-5, NSC 76588, HHIRBXHEYVDUAM-UHFFFAOYSA-N, Y54698FM83, 3-chlorobenzenisocyanate, m-chlorophenylisocyanate, m-chlorophenyliso-cyanate, 3-chlorophenyl-isocyanate, 3chloro-phenyl isocyanate, WLN: OCNR CG, ACMC-1CCA0, 3-chloro phenyl isocyanate, 3-chloro-phenyl isocyanate, 3-chloro-phenyl-isocyanate, 3- Chlorophenyl isocyanate, EC 220-822-5, meta-chlorophenyl isocyanate, 3-chlorophenylisocyanic acid, AC1L2B2E, AC1Q3K3M, SCHEMBL58110, KSC490A5T, 1-chloro-3-isocyanato benzene, 1-chloro-3-isocyanato-benzene, 3-chloro-1-isocyanato benzene, 3-chloro-1-isocyanato-benzene, AC1Q3I15, Benzene,1-chloro-3-isocyanato-, DTXSID1062702, 3-Chlorophenyl isocyanate, 99%, CTK3J0059, EBD5897, KS-00000X7C, NSC76588, ZINC1707959, ANW-26548, BBL013128, MFCD00002016, NSC-76588, SBB058900, STK399778, AKOS000119286, MCULE-1952838679, NE10141, RTR-012725, TRA0044779, VZ35053, BP-12958, CJ-06766, CJ-28925, LS-84438, SC-78078, DB-047523, TR-012725, A5462, FT-0615511, I0119, ST50586047, EN300-21284, I01-7080, J-017387, F2190-0545, C7H4ClNO, C7-H4-Cl-N-O, CID17968, ACN-048893, 3-Chlorophenyl isocyanate, 98% - 100G 100g, 13610-02-1,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.998g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	153.565g/mol
Monoisotopic Mass	152.998g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	29.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H314-H330-H334
Packing Group	Ⅲ
Precautionary statements	P260-P280-P284-P305+P351+P338-P310
UN Code	UN 2206

Certificate of Analysis

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