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Home > Aldehydes > 1228594-41-9
1228594-41-9 | [1,1'-Biphenyl]-4-carboxaldehyde, 2'-(hydroxymethyl)-
CAS No: 1228594-41-9 Catalog No: AG000JM0 MDL No:
Product Description
Catalog Number:
AG000JM0
Chemical Name:
[1,1'-Biphenyl]-4-carboxaldehyde, 2'-(hydroxymethyl)-
CAS Number:
1228594-41-9
Molecular Formula:
C14H12O2
Molecular Weight:
212.2439
IUPAC Name:
4-[2-(hydroxymethyl)phenyl]benzaldehyde
InChI:
InChI=1S/C14H12O2/c15-9-11-5-7-12(8-6-11)14-4-2-1-3-13(14)10-16/h1-9,16H,10H2
InChI Key:
UBQIRFAQMBAOQO-UHFFFAOYSA-N
SMILES:
OCc1ccccc1c1ccc(cc1)C=O
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.084g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.248g/mol
Monoisotopic Mass:
212.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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