Name: Name:1-{5H,6H,7H-pyrrolo[2,1-c][1,2,4]triazol-3-yl}ethan-1-amine
Brand: Angene
SKU: AG019KLG
Rating: 90 (10 reviews)

1-{5H,6H,7H-pyrrolo[2,1-c][1,2,4]triazol-3-yl}ethan-1-amine

CAS No.:

929973-93-3

Catalog Number:

AG019KLG

Molecular Formula:

C7H12N4

Molecular Weight:

152.1970

Catalog Number:

AG019KLG

Chemical Name:

1-{5H,6H,7H-pyrrolo[2,1-c][1,2,4]triazol-3-yl}ethan-1-amine

CAS Number:

929973-93-3

Molecular Formula:

C7H12N4

Molecular Weight:

152.1970

MDL Number:

MFCD09040605

IUPAC Name:

1-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)ethanamine

InChI:

InChI=1S/C7H12N4/c1-5(8)7-10-9-6-3-2-4-11(6)7/h5H,2-4,8H2,1H3

InChI Key:

XUTYRPGBNPZBEP-UHFFFAOYSA-N

SMILES:

CC(c1nnc2n1CCC2)N

Complexity:

149

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

152.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

152.201g/mol

Monoisotopic Mass:

152.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

56.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.9