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7149-92-0 | 2,4-Dimethoxy-3-methylbenzaldehyde
CAS No: 7149-92-0 Catalog No: AG00329A MDL No:MFCD00011489
Product Description
Catalog Number:
AG00329A
Chemical Name:
2,4-Dimethoxy-3-methylbenzaldehyde
CAS Number:
7149-92-0
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
MDL Number:
MFCD00011489
IUPAC Name:
2,4-dimethoxy-3-methylbenzaldehyde
InChI:
InChI=1S/C10H12O3/c1-7-9(12-2)5-4-8(6-11)10(7)13-3/h4-6H,1-3H3
InChI Key:
UOKAZUWUHOBBMD-UHFFFAOYSA-N
SMILES:
COc1c(C=O)ccc(c1C)OC
NSC Number:
72349
Properties
Complexity:
170
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:
0
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Evolution of a total synthesis of (-)-kendomycin exploiting a Petasis-Ferrier rearrangement/ring-closing olefin metathesis strategy. | Journal of the American Chemical Society 20060419 |
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