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120321-72-4

120321-72-4 | (1-Methyl-1H-benzo[d][1,2,3]triazol-5-yl)methanol

CAS No: 120321-72-4 Catalog No: AG00386P MDL No:MFCD00962482

Product Description

Catalog Number:
AG00386P
Chemical Name:
(1-Methyl-1H-benzo[d][1,2,3]triazol-5-yl)methanol
CAS Number:
120321-72-4
Molecular Formula:
C8H9N3O
Molecular Weight:
163.1766
MDL Number:
MFCD00962482
IUPAC Name:
(1-methylbenzotriazol-5-yl)methanol
InChI:
InChI=1S/C8H9N3O/c1-11-8-3-2-6(5-12)4-7(8)9-10-11/h2-4,12H,5H2,1H3
InChI Key:
HVLCKOBNGNRDPT-UHFFFAOYSA-N
SMILES:
OCc1ccc2c(c1)nnn2C

Properties

Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.075g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.18g/mol
Monoisotopic Mass:
163.075g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  

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