Name: Name:N3-(2,3-dihydrobenzofuran-3-yl)-4H-1,2,4-triazole-3,5-diamine
Brand: Angene
SKU: AG01DVIC
Rating: 90 (10 reviews)

N3-(2,3-dihydrobenzofuran-3-yl)-4H-1,2,4-triazole-3,5-diamine

CAS No.:

1518944-61-0

Catalog Number:

AG01DVIC

Molecular Formula:

C10H11N5O

Molecular Weight:

217.2272

Catalog Number:

AG01DVIC

Chemical Name:

N3-(2,3-dihydrobenzofuran-3-yl)-4H-1,2,4-triazole-3,5-diamine

CAS Number:

1518944-61-0

Molecular Formula:

C10H11N5O

Molecular Weight:

217.2272

MDL Number:

MFCD21737231

IUPAC Name:

3-N-(2,3-dihydro-1-benzofuran-3-yl)-1H-1,2,4-triazole-3,5-diamine

InChI:

InChI=1S/C10H11N5O/c11-9-13-10(15-14-9)12-7-5-16-8-4-2-1-3-6(7)8/h1-4,7H,5H2,(H4,11,12,13,14,15)

InChI Key:

GRINOSYZMRTBQI-UHFFFAOYSA-N

SMILES:

Nc1nnc([nH]1)NC1COc2c1cccc2

Complexity:

251

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

217.096g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

217.232g/mol

Monoisotopic Mass:

217.096g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

88.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2