AG003O2T

56278-50-3 | 2-(Benzo[d]thiazol-2-yl)acetonitrile

AG003O2T

SDS

COA

Price

$0.00

WARNING This product is not for human or veterinary use.

CAS Number	56278-50-3
Catalog Number	AG003O2T(AGN-PC-0JMETT)
Chemical Name	2-(Benzo[d]thiazol-2-yl)acetonitrile
IUPAC Name	2-(1,3-benzothiazol-2-yl)acetonitrile
InChI	InChI=1S/C9H6N2S/c10-6-5-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5H2
InChI Key	ZMZSYUSDGRJZNT-UHFFFAOYSA-N
MDL Number	MFCD00051633
Molecular Formula	C9H6N2S
Molecular Weight	174.2223
NSC Number	379416
SMILES	N#CCC1=NC2=CC=CC=C2S1
Synonyms	56278-50-3, Benzothiazole-2-acetonitrile, 2-(benzo[d]thiazol-2-yl)acetonitrile, 2-Benzothiazoleacetonitrile, 2-(1,3-benzothiazol-2-yl)acetonitrile, Benzothiazole-2-yl-acetonitrile, 2-Cyanomethyl-1,3-benzothiazole, 1,3-Benzothiazol-2-ylacetonitrile, Benzothiazol-2-ylacetonitrile, ZMZSYUSDGRJZNT-UHFFFAOYSA-N, MFCD00051633, 2-benzothiazol-2-ylethanenitrile, NSC379416, 2-cyanomethylbenzothiazole, Maybridge1_003801, 2-cyanomethyl-benzthiazole, AC1L7W7U, SCHEMBL76564, KSC269I0R, SCHEMBL2520974, 2-(benzothiazolyl)-acetonitrile, CTK1G9408, HMS552E17, KS-00000UYM, ZINC80476, ZMZSYUSDGRJZNT-UHFFFAOYSA-, DTXSID00321646, 2-Benzothiazoleacetonitrile, 98%, 1,3-benzothiazol-2yl-acetonitrile, 2-(Benzothiazol-2-yl)acetonitrile, BCP21425, CS-M0204, EBD25676, 1,3-benzothiazol-2-yl-acetonitrile, 2-(Cyanomethyl)-1,3-benzothiazole, ANW-32475, BBL009637, CB0170, FC0633, SBB039173, STK318007, (1,3-benzothiazol-2-yl)acetonitrile, 1,3-Benzothiazol-2-ylacetonitrile #, AKOS000265902, CB-2109, FS-2251, GL-0835, MCULE-3352572406, NSC-379416, QC-1338, SDCCGMLS-0066103.P001, TRA0033308, VT10162, AJ-10495, AK-79181, AN-40208, CJ-00634, ST081362, ZB002841, AB0018038, DB-013386, RT-001657, ST2416152, BB 0218398, FT-0622730, A-2418, 278B503, SR-01000532980, I10-0457, SR-01000532980-1, Z56935286, F1673-3350, InChI=1/C9H6N2S/c10-6-5-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5H2, C9H6N2S, 2-Benzothiazoleacetonitrile (9CI), CID342465, ACN-051580, R191, A13564,

Complexity	208
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	174.025g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	174.221g/mol
Monoisotopic Mass	174.025g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	64.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302+H312+H332-H315-H319-H335
Precuationary statements	P261-P280-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number