Name: Name:7-methoxy-1H-1,3-benzodiazole-5-carbaldehyde
Brand: Angene
SKU: AG01EM9J
Rating: 90 (10 reviews)

7-methoxy-1H-1,3-benzodiazole-5-carbaldehyde

CAS No.:

1806623-22-2

Catalog Number:

AG01EM9J

Molecular Formula:

C9H8N2O2

Molecular Weight:

176.1720

Catalog Number:

AG01EM9J

Chemical Name:

7-methoxy-1H-1,3-benzodiazole-5-carbaldehyde

CAS Number:

1806623-22-2

Molecular Formula:

C9H8N2O2

Molecular Weight:

176.1720

MDL Number:

MFCD28950422

IUPAC Name:

7-methoxy-3H-benzimidazole-5-carbaldehyde

InChI:

InChI=1S/C9H8N2O2/c1-13-8-3-6(4-12)2-7-9(8)11-5-10-7/h2-5H,1H3,(H,10,11)

InChI Key:

KOCPMKIABQPDAV-UHFFFAOYSA-N

SMILES:

COc1cc(C=O)cc2c1[nH]cn2

Complexity:

198

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

176.059g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

176.175g/mol

Monoisotopic Mass:

176.059g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9