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690264-15-4

690264-15-4 | 3-(4-HYDROXYMETHYL-PHENYL)-PROPIONALDEHYDE

CAS No: 690264-15-4 Catalog No: AG006DU0 MDL No:

Product Description

Catalog Number:
AG006DU0
Chemical Name:
3-(4-HYDROXYMETHYL-PHENYL)-PROPIONALDEHYDE
CAS Number:
690264-15-4
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
IUPAC Name:
3-[4-(hydroxymethyl)phenyl]propanal
InChI:
InChI=1S/C10H12O2/c11-7-1-2-9-3-5-10(8-12)6-4-9/h3-7,12H,1-2,8H2
InChI Key:
XYRQKOIGTLRXEH-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1)CCC=O

Properties

Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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