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77177-24-3 | 1H-1,2,3-Triazole-4-methanol, 1-heptyl-
CAS No: 77177-24-3 Catalog No: AG00557V MDL No:
Product Description
Catalog Number:
AG00557V
Chemical Name:
1H-1,2,3-Triazole-4-methanol, 1-heptyl-
CAS Number:
77177-24-3
Molecular Formula:
C10H19N3O
Molecular Weight:
197.2774
IUPAC Name:
(1-heptyltriazol-4-yl)methanol
InChI:
InChI=1S/C10H19N3O/c1-2-3-4-5-6-7-13-8-10(9-14)11-12-13/h8,14H,2-7,9H2,1H3
InChI Key:
PRZSQBMDQIOHLF-UHFFFAOYSA-N
SMILES:
CCCCCCCn1nnc(c1)CO
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.153g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.282g/mol
Monoisotopic Mass:
197.153g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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