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Home > Aldehydes > 106331-79-7
106331-79-7 | Benzaldehyde, 3-iodo-5-methoxy-4-(2-propenyloxy)-
CAS No: 106331-79-7 Catalog No: AG007V1Y MDL No:MFCD02257204
Product Description
Catalog Number:
AG007V1Y
Chemical Name:
Benzaldehyde, 3-iodo-5-methoxy-4-(2-propenyloxy)-
CAS Number:
106331-79-7
Molecular Formula:
C11H11IO3
Molecular Weight:
318.1077
MDL Number:
MFCD02257204
IUPAC Name:
3-iodo-5-methoxy-4-prop-2-enoxybenzaldehyde
InChI:
InChI=1S/C11H11IO3/c1-3-4-15-11-9(12)5-8(7-13)6-10(11)14-2/h3,5-7H,1,4H2,2H3
InChI Key:
OVJZJVITAXJCFN-UHFFFAOYSA-N
SMILES:
C=CCOc1c(I)cc(cc1OC)C=O
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.975g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.11g/mol
Monoisotopic Mass:
317.975g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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