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306990-95-4

306990-95-4 | Methanone, 1H-benzotriazol-1-yl-1-naphthalenyl-

CAS No: 306990-95-4 Catalog No: AG0030ZD MDL No:MFCD01173090

Product Description

Catalog Number:
AG0030ZD
Chemical Name:
Methanone, 1H-benzotriazol-1-yl-1-naphthalenyl-
CAS Number:
306990-95-4
Molecular Formula:
C17H11N3O
Molecular Weight:
273.2887
MDL Number:
MFCD01173090
IUPAC Name:
benzotriazol-1-yl(naphthalen-1-yl)methanone
InChI:
InChI=1S/C17H11N3O/c21-17(20-16-11-4-3-10-15(16)18-19-20)14-9-5-7-12-6-1-2-8-13(12)14/h1-11H
InChI Key:
SOUJWQBDUNGZJE-UHFFFAOYSA-N
SMILES:
O=C(n1nnc2c1cccc2)c1cccc2c1cccc2

Properties

Complexity:
400  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.09g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.295g/mol
Monoisotopic Mass:
273.09g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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