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Home > Aldehydes > 110943-74-3
110943-74-3 | Benzaldehyde, 4-hydroxy-3-propoxy-
CAS No: 110943-74-3 Catalog No: AG008381 MDL No:
Product Description
Catalog Number:
AG008381
Chemical Name:
Benzaldehyde, 4-hydroxy-3-propoxy-
CAS Number:
110943-74-3
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
IUPAC Name:
4-hydroxy-3-propoxybenzaldehyde
InChI:
InChI=1S/C10H12O3/c1-2-5-13-10-6-8(7-11)3-4-9(10)12/h3-4,6-7,12H,2,5H2,1H3
InChI Key:
CBKYEFKMNADVGO-UHFFFAOYSA-N
SMILES:
CCCOc1cc(C=O)ccc1O
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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