Home Other Building Blocks N-PHENYLBENZOTRIAZOLEMETHANAMINE

N-PHENYLBENZOTRIAZOLEMETHANAMINE

CAS No.:
62001-29-0
Catalog Number:
AG00ELLS
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$142
- +
5g
95%
1 week
United States
$399
- +
Product Description
Catalog Number:
AG00ELLS
Chemical Name:
N-PHENYLBENZOTRIAZOLEMETHANAMINE
CAS Number:
62001-29-0
MDL Number:
MFCD00160026
IUPAC Name:
N-(benzotriazol-1-ylmethyl)aniline
InChI:
InChI=1S/C13H12N4/c1-2-6-11(7-3-1)14-10-17-13-9-5-4-8-12(13)15-16-17/h1-9,14H,10H2
InChI Key:
XEZLZOGOVRJQMO-UHFFFAOYSA-N
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.106g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.267g/mol
Monoisotopic Mass:
224.106g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Literature
Title Journal
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
Properties