AG00IB5B

6306-60-1 | Benzeneacetonitrile, 2,4-dichloro-

AG00IB5B

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CAS Number	6306-60-1
Catalog Number	AG00IB5B(AGN-PC-0JLSQ5)
Chemical Name	Benzeneacetonitrile, 2,4-dichloro-
EC Number	228-621-4
IUPAC Name	2-(2,4-dichlorophenyl)acetonitrile
InChI	InChI=1S/C8H5Cl2N/c9-7-2-1-6(3-4-11)8(10)5-7/h1-2,5H,3H2
InChI Key	VJARIBGMDPJLCL-UHFFFAOYSA-N
MDL Number	MFCD00001899
Molecular Formula	C8H5Cl2N
Molecular Weight	186.0380
NSC Number	22988
SMILES	C(C#N)c1c(Cl)cc(cc1)Cl
UNII	D9J4C5M11E
Synonyms	2,4-Dichlorophenylacetonitrile, 6306-60-1, 2-(2,4-Dichlorophenyl)acetonitrile, 2,4-Dichlorobenzyl cyanide, Benzeneacetonitrile, 2,4-dichloro-, (2,4-Dichlorophenyl)acetonitrile, 2,4-Dichlorobenzeneacetonitrile, UNII-D9J4C5M11E, Acetonitrile, (2,4-dichlorophenyl)-, D9J4C5M11E, VJARIBGMDPJLCL-UHFFFAOYSA-N, (2,4-dichloro-phenyl)-acetonitrile, MFCD00001899, (2,4-dichlorphenyl)acetonitril, 2-(2,4-dichlorophenyl)ethanenitrile, EINECS 228-621-4, PubChem9014, ACMC-209ncm, AI3-12073, AC1L2ZOF, AC1Q3MCW, AC1Q3I5V, DSSTox_CID_21185, DSSTox_RID_79641, DSSTox_GSID_41185, KSC493O6T, SCHEMBL549082, 2,4-DCCN, Benzeneacetonitrile,4-dichloro-, 2,4-dichlorophenyl acetonitrile, 2,4-dichlorophenyl-acetonitrile, Acetonitrile,4-dichlorophenyl)-, CHEMBL3183818, DTXSID6041185, CTK3J3769, KS-00000JKL, VJARIBGMDPJLCL-UHFFFAOYSA-, ATTERCOP-CHM AT109895, OTAVA-BB 1519439, ZINC164084, NSC22988, STR00977, Tox21_301022, ANW-34532, KM0696, NSC-22988, SBB064695, 2,4-Dichlorophenylacetonitrile, 98%, AKOS000119594, AS01670, MCULE-2332278648, RP24591, VZ22550, NCGC00248259-01, NCGC00254924-01, AC-23570, AJ-16095, AK-88981, CJ-02109, ZB008074, CAS-6306-60-1, AB0010878, AB1007957, RT-001694, TL8004373, D1792, FT-0610052, FT-0610069, ST24021636, ST50406638, 306D601, I01-5479, W-104935, F0001-1712, Z1263529558, InChI=1/C8H5Cl2N/c9-7-2-1-6(3-4-11)8(10)5-7/h1-2,5H,3H2, C8H5Cl2N, C8-H5-Cl2-N, 2, 4-Dichlorobenzeneacetonitrile, 2,4-DICHLOROBENZYLCYANIDE, KST-1A7052, CID80566, AR-1A1922, 2,4-Dichlorophenylacetonitrile, 99% - 1KG 1kg, 63978-33-6,

Complexity	172
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.98g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	186.035g/mol
Monoisotopic Mass	184.98g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	23.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number