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Home > Aldehydes > 886498-63-1
886498-63-1 | 6-Hydroxy-3-methoxy-2,4-dimethyl-benzaldehyde
CAS No: 886498-63-1 Catalog No: AG01EYD0 MDL No:
Product Description
Catalog Number:
AG01EYD0
Chemical Name:
6-Hydroxy-3-methoxy-2,4-dimethyl-benzaldehyde
CAS Number:
886498-63-1
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
IUPAC Name:
6-hydroxy-3-methoxy-2,4-dimethylbenzaldehyde
InChI:
InChI=1S/C10H12O3/c1-6-4-9(12)8(5-11)7(2)10(6)13-3/h4-5,12H,1-3H3
InChI Key:
UUHAVXUWZJTTPX-UHFFFAOYSA-N
SMILES:
COc1c(C)cc(c(c1C)C=O)O
Properties
Complexity:
181
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:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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