Name: Name:2-(4,5,6,7-tetrahydro-1H-1,3-benzodiazol-1-yl)acetic acid
Brand: Angene
SKU: AG01A4NP
Rating: 90 (10 reviews)

2-(4,5,6,7-tetrahydro-1H-1,3-benzodiazol-1-yl)acetic acid

CAS No.:

1092286-74-2

Catalog Number:

AG01A4NP

Molecular Formula:

C9H12N2O2

Molecular Weight:

180.2038

Catalog Number:

AG01A4NP

Chemical Name:

2-(4,5,6,7-tetrahydro-1H-1,3-benzodiazol-1-yl)acetic acid

CAS Number:

1092286-74-2

Molecular Formula:

C9H12N2O2

Molecular Weight:

180.2038

MDL Number:

MFCD11226756

IUPAC Name:

2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetic acid

InChI:

InChI=1S/C9H12N2O2/c12-9(13)5-11-6-10-7-3-1-2-4-8(7)11/h6H,1-5H2,(H,12,13)

InChI Key:

XJDAVGNSIUIIGA-UHFFFAOYSA-N

SMILES:

OC(=O)Cn1cnc2c1CCCC2

Complexity:

208

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

180.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

180.207g/mol

Monoisotopic Mass:

180.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8