Name: Name:phenyl(4H-1,2,4-triazol-3-yl)methanol
Brand: Angene
SKU: AG01E92M
Rating: 90 (10 reviews)

phenyl(4H-1,2,4-triazol-3-yl)methanol

CAS No.:

18011-28-4

Catalog Number:

AG01E92M

Molecular Formula:

C9H9N3O

Molecular Weight:

175.1873

Catalog Number:

AG01E92M

Chemical Name:

phenyl(4H-1,2,4-triazol-3-yl)methanol

CAS Number:

18011-28-4

Molecular Formula:

C9H9N3O

Molecular Weight:

175.1873

MDL Number:

MFCD21194799

IUPAC Name:

phenyl(1H-1,2,4-triazol-5-yl)methanol

InChI:

InChI=1S/C9H9N3O/c13-8(9-10-6-11-12-9)7-4-2-1-3-5-7/h1-6,8,13H,(H,10,11,12)

InChI Key:

LMZVNLVHAMIVEJ-UHFFFAOYSA-N

SMILES:

OC(c1nnc[nH]1)c1ccccc1

Complexity:

159

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

175.075g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

175.191g/mol

Monoisotopic Mass:

175.075g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

61.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8