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58380-40-8 | 4-hydroxy-2,3-dimethylbenzaldehyde
CAS No: 58380-40-8 Catalog No: AG01CA5T MDL No:MFCD22414657
Product Description
Catalog Number:
AG01CA5T
Chemical Name:
4-hydroxy-2,3-dimethylbenzaldehyde
CAS Number:
58380-40-8
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
MDL Number:
MFCD22414657
IUPAC Name:
4-hydroxy-2,3-dimethylbenzaldehyde
InChI:
InChI=1S/C9H10O2/c1-6-7(2)9(11)4-3-8(6)5-10/h3-5,11H,1-2H3
InChI Key:
GEVILTWPAPSGDK-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1C)C)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:
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:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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