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57295-30-4 | 3-Hydroxy-4-methylbenzaldehyde
CAS No: 57295-30-4 Catalog No: AG00376F MDL No:MFCD01632496
Product Description
Catalog Number:
AG00376F
Chemical Name:
3-Hydroxy-4-methylbenzaldehyde
CAS Number:
57295-30-4
Molecular Formula:
C8H8O2
Molecular Weight:
136.1479
MDL Number:
MFCD01632496
IUPAC Name:
3-hydroxy-4-methylbenzaldehyde
InChI:
InChI=1S/C8H8O2/c1-6-2-3-7(5-9)4-8(6)10/h2-5,10H,1H3
InChI Key:
DHVJHJQBQKKPNB-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)O)C
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.052g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
136.15g/mol
Monoisotopic Mass:
136.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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