AG0033U4

35037-73-1 | 4-(Trifluoromethoxy)phenyl isocyanate

AG0033U4

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CAS Number	35037-73-1
Catalog Number	AG0033U4(AGN-PC-0JLZKW)
Chemical Name	4-(Trifluoromethoxy)phenyl isocyanate
EC Number	252-328-0
IUPAC Name	1-isocyanato-4-(trifluoromethoxy)benzene
InChI	InChI=1S/C8H4F3NO2/c9-8(10,11)14-7-3-1-6(2-4-7)12-5-13/h1-4H
InChI Key	LGPKFIGMLPDYEA-UHFFFAOYSA-N
MDL Number	MFCD00035702
Molecular Formula	C8H4F3NO2
Molecular Weight	203.1181
SMILES	O=C=Nc1ccc(OC(F)(F)F)cc1
Synonyms	4-(Trifluoromethoxy)phenyl isocyanate, 35037-73-1, 1-Isocyanato-4-(trifluoromethoxy)benzene, 4-trifluoromethoxyphenylisocyanate, 4-(Trifluoromethoxy)phenylisocyanate, Benzene, 1-isocyanato-4-(trifluoromethoxy)-, 1-Isocyanato-4-trifluoromethoxy-benzene, MFCD00035702, C8H4F3NO2, 4-Trifluoromethoxy phenylisocyanate, p-(Trifluoromethoxy)phenyl isocyanate, LGPKFIGMLPDYEA-UHFFFAOYSA-N, 4-trifluoromethoxyphenyl isocyanate, 4-(trifluoromethoxy)benzenisocyanate, Isocyanic Acid 4-(Trifluoromethoxy)phenyl Ester, EINECS 252-328-0, PubChem4461, PubChem7022, ACMC-1AJIR, AC1L3NTY, AC1Q4KER, EC 252-328-0, KSC222E7P, SCHEMBL180952, Jsp006322, DTXSID1067883, CTK1C2277, KS-00000EMF, EBD9768, p-trifluoromethoxyphenyl isocyanate, 4-trifluoromethoxy-phenylisocyanate, ZINC164525, 4-trifluoromethoxy- phenylisocyanate, 4-trifluoromethoxy-phenyl isocyanate, ACT03277, ANW-28052, SBB063245, 1-isocyanato-4-trifluoromethoxybenzene, 4-(trifluoromethoxy)-phenyl isocyanate, AKOS005063774, p-(trifluoromethoxy)-phenyl isocyanate, AC-9801, AM62607, AS00720, AS04334, TRA0024399, CJ-02160, L580, SC-03724, ZB008184, 1-Isocyanato-4-(trifluoromethoxy)-benzene, 1-Isocyanato-4-(trifluoromethoxy)benzene #, DB-026149, RT-002502, 4-(Trifluoromethoxy)phenyl isocyanate, 98%, A6147, FT-0618819, ST50825501, K-7950, 11960-EP2301534A1, 11960-EP2311451A1, 11960-EP2316450A1, 38129-EP2308832A1, 38129-EP2311796A1, 38129-EP2311797A1, 38129-EP2311798A1, 38129-EP2311799A1, 037T731, I01-0988, W-106694, Azoxydapsone, C8-H4-F3-N-O2, CID92298, T2487, 4-(Trifluoromethoxy)phenyl isocyanate, 97% 1g, 2,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANOL, 4-(Trifluoromethoxy)phenyl isocyanate, 98% - 1G 1g, 1563-38-8,

Complexity	227
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.019g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	203.12g/mol
Monoisotopic Mass	203.019g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	38.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H227-H301+H331-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P210-P261-P264-P270-P271-P280-P301+P310+P330-P302+P352+P332+P313+P362+P364-P304+P340+P311-P305+P351+P338+P337+P313-P403+P233-P405-P501
UN Code	UN 2206

Certificate of Analysis

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