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26172-10-1 | Benzenepropanal, 3-hydroxy-
CAS No: 26172-10-1 Catalog No: AG002S01 MDL No:
Product Description
Catalog Number:
AG002S01
Chemical Name:
Benzenepropanal, 3-hydroxy-
CAS Number:
26172-10-1
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
IUPAC Name:
3-(3-hydroxyphenyl)propanal
InChI:
InChI=1S/C9H10O2/c10-6-2-4-8-3-1-5-9(11)7-8/h1,3,5-7,11H,2,4H2
InChI Key:
AMQRNDIFPLIQBP-UHFFFAOYSA-N
SMILES:
O=CCCc1cccc(c1)O
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:
1.3
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