AG003L9G

2719-32-6 | 4-Cyanophenyl Isothiocyanate

AG003L9G

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	2719-32-6
Catalog Number	AG003L9G(AGN-PC-0JKDKO)
Chemical Name	4-Cyanophenyl Isothiocyanate
EC Number	220-323-2
IUPAC Name	4-isothiocyanatobenzonitrile
InChI	InChI=1S/C8H4N2S/c9-5-7-1-3-8(4-2-7)10-6-11/h1-4H
InChI Key	DZFKAXLNKZXNHD-UHFFFAOYSA-N
MDL Number	MFCD00041085
Molecular Formula	C8H4N2S
Molecular Weight	160.1958
SMILES	C(#N)C1=CC=C(C=C1)N=C=S
Synonyms	4-Cyanophenyl isothiocyanate, 4-Isothiocyanatobenzonitrile, 2719-32-6, Benzonitrile, 4-isothiocyanato-, p-Cyanophenyl isothiocyanate, 4-cyanophenylisothiocyanate, 4-Cyano-phenyl-isothiocyanate, 4-Isothiocyanatobenzenenitrile, ISOTHIOCYANIC ACID, p-CYANOPHENYL ESTER, EINECS 220-323-2, BRN 2802621, 4-isothiocyanato-benzonitrile, Benzonitrile,4-isothiocyanato-, Benzenenitrile, 4-isothiocyanato-, 4-isothiocyanatobenzenecarbonitrile, DZFKAXLNKZXNHD-UHFFFAOYSA-N, 4-Cyanophenyl isothiocyanate, 98%, MFCD00041085, ACMC-20amk7, AC1L2ACQ, AC1Q7EXU, 4cyanophenyl isothiocyanate, 3-14-00-01135 (Beilstein Handbook Reference), SCHEMBL786739, 4-Isothiocyanatobenzonitrile #, DTXSID3062609, CTK4F9251, AKOS JY2036963, ZINC152332, BCP20904, CC-809, GEO-03414, SBB087450, AKOS000212142, AN-6180, AS00354, CS-W000364, NE61434, RP02141, TRA0072074, VZ35427, Benzenenitrile, 4-isothiocyanato- (9CI), BP-12808, FS000068, LS-86408, SC-44724, ZB005164, TC-168910, FT-0084429, FT-0618852, ST50824778, Y8519, EN300-60955, A818950, I09-3279, J-016688, J-515609, InChI=1/C8H4N2S/c9-5-7-1-3-8(4-2-7)10-6-11/h1-4, C8H4N2S, C8-H4-N2-S, CID17626,

Complexity	214
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	160.01g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	160.194g/mol
Monoisotopic Mass	160.01g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	68.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H312-H314-H332
Packing Group	Ⅲ
Precautionary statements	P260-P261-P264-P270-P271-P280-P301+P312-P301+P330+P331-P302+P352-P303+P361+P353-P304+P340-P305+P351+P338-P310-P312-P321-P322-P330-P363-P405-P501
UN Code	UN 1759

Certificate of Analysis

Lot Number