AG003L6O

623-03-0 | 4-Chlorobenzonitrile

AG003L6O

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CAS Number	623-03-0
Catalog Number	AG003L6O(AGN-PC-0CE2WY)
Chemical Name	4-Chlorobenzonitrile
EC Number	210-765-4
IUPAC Name	4-chlorobenzonitrile
InChI	InChI=1S/C7H4ClN/c8-7-3-1-6(5-9)2-4-7/h1-4H
InChI Key	GJNGXPDXRVXSEH-UHFFFAOYSA-N
MDL Number	MFCD00001813
Molecular Formula	C7H4ClN
Molecular Weight	137.5664
NSC Number	6111
SMILES	ClC1=CC=C(C=C1)C#N
UNII	4Z0HGP3A8A
Synonyms	4-CHLOROBENZONITRILE, 623-03-0, p-Chlorobenzonitrile, Benzonitrile, 4-chloro-, p-Cyanochlorobenzene, Benzonitrile, p-chloro-, 4-Cyanochlorobenzene, Nitril kyseliny p-chlorbenzoove, p-CHLORBENZONITRILE, UNII-4Z0HGP3A8A, PCBN, 4-chloro benzonitrile, 4-chloro-benzonitrile, NSC 6111, EINECS 210-765-4, 4-Chlorobenzonitrile, 99%, Nitril kyseliny p-chlorbenzoove [Czech], 4Z0HGP3A8A, AI3-00492, GJNGXPDXRVXSEH-UHFFFAOYSA-N, MFCD00001813, 4-chlorobenzenecarbonitrile, 4-chlorbenzonitrile, p-Chlorocyanobenzene, 4-chiorobenzonitrile, 4-chlorocyanobenzene, p-chloro benzonitrile, PubChem20405, AC1L1YZI, WLN: NCR DG, EC 210-765-4, ACMC-1B19I, DSSTox_CID_24703, DSSTox_RID_80408, 4-Chlorobenzoic acid nitrile, DSSTox_GSID_44703, SCHEMBL72752, 4-chloranylbenzenecarbonitrile, KSC352S3H, CHEMBL3188114, DTXSID8044703, CTK2F2933, TIMTEC-BB SBB028659, NSC6111, AKOS B004081, ART-CHEM-BB B004081, ZINC157255, BCP21256, NSC-6111, STR01164, Tox21_301477, ANW-34144, LABOTEST-BB LT01147713, LABOTEST-BB LT03330779, SBB028659, STK398305, AKOS000304421, AS02369, CM12995, CS-W018544, MCULE-8900705941, RP20384, RTR-021414, TRA0060849, OTAVA-BB 7119850520, NCGC00256042-01, AJ-14965, AK-54448, AN-46751, BR-54448, CAS-623-03-0, CJ-01626, LS-38654, SC-25979, SY003818, ZB006619, AB1002945, ST2411358, TL8004098, TR-021414, FT-0618186, FT-0653591, ST50716069, AZ0001-0053, MFCD00001813 (98%), M-6018, A833702, I01-0589, I01-6874, W-105017, F0001-1667, InChI=1/C7H4ClN/c8-7-3-1-6(5-9)2-4-7/h1-4, C7H4ClN, C7-H4-Cl-N, 4-Chlorobenzonitrile, 99% 50g, ACN-S002227, CID12163, c0135, 4-Chlorobenzonitrile, 99% - 100G 100g,

Complexity	127
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	137.003g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	137.566g/mol
Monoisotopic Mass	137.003g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	23.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number