Name: Name:5H-Pyrrolo[1,2-b][1,2,4]triazole-5-methanol, 6,7-dihydro-, (5S)-
Brand: Angene
SKU: AG000I3R
Rating: 90 (10 reviews)

5H-Pyrrolo[1,2-b][1,2,4]triazole-5-methanol, 6,7-dihydro-, (5S)-

CAS No.:

1190392-80-3

Catalog Number:

AG000I3R

Molecular Formula:

C6H9N3O

Molecular Weight:

139.1552

Catalog Number:

AG000I3R

Chemical Name:

5H-Pyrrolo[1,2-b][1,2,4]triazole-5-methanol, 6,7-dihydro-, (5S)-

CAS Number:

1190392-80-3

Molecular Formula:

C6H9N3O

Molecular Weight:

139.1552

MDL Number:

MFCD19690775

IUPAC Name:

[(5S)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazol-5-yl]methanol

InChI:

InChI=1S/C6H9N3O/c10-3-5-1-2-6-7-4-8-9(5)6/h4-5,10H,1-3H2/t5-/m0/s1

InChI Key:

OKLMNNIODAMXJU-YFKPBYRVSA-N

SMILES:

OC[C@@H]1CCc2n1ncn2

Complexity:

130

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

139.075g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

139.158g/mol

Monoisotopic Mass:

139.075g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

50.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.3