200,000+ products from a single source!
sales@angenechem.com
76646-42-9 | Benzaldehyde,3-(hydroxymethyl)-4-methoxy-
CAS No: 76646-42-9 Catalog No: AG005J71 MDL No:MFCD00778411
Product Description
Catalog Number:
AG005J71
Chemical Name:
Benzaldehyde,3-(hydroxymethyl)-4-methoxy-
CAS Number:
76646-42-9
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
MDL Number:
MFCD00778411
IUPAC Name:
3-(hydroxymethyl)-4-methoxybenzaldehyde
InChI:
InChI=1S/C9H10O3/c1-12-9-3-2-7(5-10)4-8(9)6-11/h2-5,11H,6H2,1H3
InChI Key:
SQNWBFUAFUQJNU-UHFFFAOYSA-N
SMILES:
OCc1cc(C=O)ccc1OC
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.176g/mol
Monoisotopic Mass:
166.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.