AG00EIJS

58068-80-7 | 1-Octanoylbenzotriazole

AG00EIJS

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	58068-80-7
Catalog Number	AG00EIJS(AGN-PC-0KPAQH)
Chemical Name	1-Octanoylbenzotriazole
IUPAC Name	1-(benzotriazol-1-yl)octan-1-one
InChI	InChI=1S/C14H19N3O/c1-2-3-4-5-6-11-14(18)17-13-10-8-7-9-12(13)15-16-17/h7-10H,2-6,11H2,1H3
InChI Key	QIYQQEDMCSJOAC-UHFFFAOYSA-N
MDL Number	MFCD00690106
Molecular Formula	C14H19N3O
Molecular Weight	245.3202
SMILES	CCCCCCCC(=O)N1N=NC2=C1C=CC=C2
Synonyms	58068-80-7, 1-(1H-Benzo[d][1,2,3]triazol-1-yl)octan-1-one, 1-OCTANOYLBENZOTRIAZOLE, N-OCTANOYL BENZOTRIAZOLE, 1-Octanoyl benzotriazole, 1-(benzotriazol-1-yl)octan-1-one, BAS 00397221, AC1MJ0XU, 1-Octanoyl-1H-benzotriazole, SCHEMBL534984, CTK5A7810, KS-00000QNK, DTXSID70389273, 1-Benzotriazol-1-yl-octan-1-one, ZINC3065201, 8584AB, ANW-71254, EBD209651, MFCD00690106, AKOS000741911, ACN-036585, DS-4234, 1-(1H-Benzotriazol-1-yl)octan-1-one, AK104516, AX8238724, TC-159999, FT-0608180, ST24036984, C14H19N3O, CID3104784,

Complexity	270
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	245.153g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	245.326g/mol
Monoisotopic Mass	245.153g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	47.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number