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Home > Aldehydes > 433228-94-5
433228-94-5 | Benzeneacetaldehyde,3-(hydroxymethyl)-
CAS No: 433228-94-5 Catalog No: AG00745K MDL No:MFCD24684368
Product Description
Catalog Number:
AG00745K
Chemical Name:
Benzeneacetaldehyde,3-(hydroxymethyl)-
CAS Number:
433228-94-5
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
MDL Number:
MFCD24684368
IUPAC Name:
2-[3-(hydroxymethyl)phenyl]acetaldehyde
InChI:
InChI=1S/C9H10O2/c10-5-4-8-2-1-3-9(6-8)7-11/h1-3,5-6,11H,4,7H2
InChI Key:
YOXQUFXICPQFSW-UHFFFAOYSA-N
SMILES:
O=CCc1cccc(c1)CO
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
150.177g/mol
Monoisotopic Mass:
150.068g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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