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124337-33-3

124337-33-3 | 1-(1H-Indol-1-ylmethyl)-1H-1,2,3-benzotriazole

CAS No: 124337-33-3 Catalog No: AG01ER7H MDL No:MFCD00431137

Product Description

Catalog Number:
AG01ER7H
Chemical Name:
1-(1H-Indol-1-ylmethyl)-1H-1,2,3-benzotriazole
CAS Number:
124337-33-3
Molecular Formula:
C15H12N4
Molecular Weight:
248.2826
MDL Number:
MFCD00431137
IUPAC Name:
1-(indol-1-ylmethyl)benzotriazole
InChI:
InChI=1S/C15H12N4/c1-3-7-14-12(5-1)9-10-18(14)11-19-15-8-4-2-6-13(15)16-17-19/h1-10H,11H2
InChI Key:
CHXGJWXOGQXSBS-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)ccn2Cn1nnc2c1cccc2

Properties

Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.106g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.289g/mol
Monoisotopic Mass:
248.106g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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