AG003L6R

5216-25-1 | 4-Chlorobenzotrichloride

AG003L6R

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CAS Number	5216-25-1
Catalog Number	AG003L6R(AGN-PC-0JKFS6)
Chemical Name	4-Chlorobenzotrichloride
EC Number	226-009-1
IUPAC Name	1-chloro-4-(trichloromethyl)benzene
InChI	InChI=1S/C7H4Cl4/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H
InChI Key	LVZPKYYPPLUECL-UHFFFAOYSA-N
MDL Number	MFCD00000790
Molecular Formula	C7H4Cl4
Molecular Weight	229.9187
SMILES	ClC(C1=CC=C(Cl)C=C1)(Cl)Cl
UN Number	1760
UNII	1UP9GJU33S
Synonyms	AAATCT, alpha,alpha,alpha-trichloro-4-chlorotoluene, 4-CHLOROBENZOTRICHLORIDE, 1-Chloro-4-(trichloromethyl)benzene, 5216-25-1, p-Chlorobenzotrichloride, Benzene, 1-chloro-4-(trichloromethyl)-, alpha,alpha,alpha,4-Tetrachlorotoluene, p-Chlorophenyltrichloromethane, p-Trichloromethylchlorobenzene, UNII-1UP9GJU33S, CCRIS 8902, alpha,alpha,alpha-Trichloro-4-chlorotoluene, EINECS 226-009-1, p,alpha,alpha,alpha-Tetrachlorotoluene, BRN 1866549, 1UP9GJU33S, Toluene, alpha,alpha,alpha,p-tetrachloro-, AI3-02822, LVZPKYYPPLUECL-UHFFFAOYSA-N, Toluene, p,.alpha.,.alpha.,.alpha.-tetrachloro-, MFCD00000790, Toluene, p,alpha,alpha,alpha-tetrachloro-, DSSTox_CID_7593, DSSTox_RID_78519, DSSTox_GSID_27593, CAS-5216-25-1, P-chloro-benzotrichloride, p-chlorbenzotrichlorid, PubChem22049, AC1L2HZN, EC 226-009-1, 4-chlorotrichloromethylbenzene, 4-05-00-00823 (Beilstein Handbook Reference), KSC914C5B, SCHEMBL196830, p-(Trichloromethyl)chlorobenzene, CHEMBL2137820, DTXSID2027593, CTK8B4150, LVZPKYYPPLUECL-UHFFFAOYSA-, KS-000010LR, ZINC2037358, Tox21_201845, Tox21_300560, ANW-44079, STL280351, AKOS009031453, alpha,alpha,alpha-4-Tetrachlorotoluene, MCULE-7096179281, RP27852, VZ21369, NCGC00164002-01, NCGC00164002-02, NCGC00164002-03, NCGC00254515-01, NCGC00259394-01, AJ-33074, BC200587, CJ-07546, CJ-32057, LS-154201, TR-022618, FT-0618188, ST24037948, .alpha.,.alpha.,.alpha.,4-Tetrachlorotoluene, 4,.alpha.,.alpha.,.alpha.-Tetrachlorotoluene, p,.alpha.,.alpha.,.alpha.-Tetrachlorotoluene, Toluene, .alpha.,.alpha.,.alpha.,p-tetrachloro-, .alpha.,.alpha.,.alpha.-Trichloro-4-chlorotoluene, I01-7864, W-105848, InChI=1/C7H4Cl4/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H, Chlorobenzotrichloride, C7H4Cl4, p-a,a,a-Tetrachlorotoluene, a,a,a,4-tetrachlorotoluene, C7-H4-Cl4, 4-Chloro-3-iodobenzotrifluoride, CID21277, T0072, 4-Chlorobenzotrichloride, 99% - 100G 100g, ?,?,?,4-tetrachlorotoluene; p-chlorobenzotrichloride, 672-57-1,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.904g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	229.909g/mol
Monoisotopic Mass	227.907g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302+H312-H315-H319-H331-H335-H412-H350-H360
Packing Group	Ⅱ
Precautionary statements	P261-P280-P305+P351+P338-P311
UN Code	UN 1760

Certificate of Analysis

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