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81323-69-5 | Benzaldehyde, 2-hydroxy-5-propyl-
CAS No: 81323-69-5 Catalog No: AG008MOO MDL No:MFCD13191894
Product Description
Catalog Number:
AG008MOO
Chemical Name:
Benzaldehyde, 2-hydroxy-5-propyl-
CAS Number:
81323-69-5
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD13191894
IUPAC Name:
2-hydroxy-5-propylbenzaldehyde
InChI:
InChI=1S/C10H12O2/c1-2-3-8-4-5-10(12)9(6-8)7-11/h4-7,12H,2-3H2,1H3
InChI Key:
CECMKFMRWXFCND-UHFFFAOYSA-N
SMILES:
CCCc1ccc(c(c1)C=O)O
Properties
Complexity:
145
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:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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