Home Aldehydes 2-(1H-1,2,3-benzotriazol-1-yl)benzaldehyde

2-(1H-1,2,3-benzotriazol-1-yl)benzaldehyde

CAS No.:
138479-57-9
Catalog Number:
AG01B23Z
Molecular Formula:
C13H9N3O
Molecular Weight:
223.2301
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Product Description
Catalog Number:
AG01B23Z
Chemical Name:
2-(1H-1,2,3-benzotriazol-1-yl)benzaldehyde
CAS Number:
138479-57-9
Molecular Formula:
C13H9N3O
Molecular Weight:
223.2301
MDL Number:
MFCD10691310
IUPAC Name:
2-(benzotriazol-1-yl)benzaldehyde
InChI:
InChI=1S/C13H9N3O/c17-9-10-5-1-3-7-12(10)16-13-8-4-2-6-11(13)14-15-16/h1-9H
InChI Key:
BQLYPHVMQDZBRV-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1n1nnc2c1cccc2
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.075g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.235g/mol
Monoisotopic Mass:
223.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties