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Home > Aldehydes > 102357-91-5
102357-91-5 | 1H-Indole-4-carboxaldehyde, 6-methoxy-7-(phenylmethoxy)-
CAS No: 102357-91-5 Catalog No: AG000790 MDL No:
Product Description
Catalog Number:
AG000790
Chemical Name:
1H-Indole-4-carboxaldehyde, 6-methoxy-7-(phenylmethoxy)-
CAS Number:
102357-91-5
Molecular Formula:
C17H15NO3
Molecular Weight:
281.3059
IUPAC Name:
6-methoxy-7-phenylmethoxy-1H-indole-4-carbaldehyde
InChI:
InChI=1S/C17H15NO3/c1-20-15-9-13(10-19)14-7-8-18-16(14)17(15)21-11-12-5-3-2-4-6-12/h2-10,18H,11H2,1H3
InChI Key:
OISQWFYNQZSDHD-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)c2c(c1OCc1ccccc1)[nH]cc2
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.105g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.311g/mol
Monoisotopic Mass:
281.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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