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30464-91-6 | 1H-Indole-2-carboxaldehyde, 7-methoxy-
CAS No: 30464-91-6 Catalog No: AG00306J MDL No:MFCD06800926
Product Description
Catalog Number:
AG00306J
Chemical Name:
1H-Indole-2-carboxaldehyde, 7-methoxy-
CAS Number:
30464-91-6
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
MDL Number:
MFCD06800926
IUPAC Name:
7-methoxy-1H-indole-2-carbaldehyde
InChI:
InChI=1S/C10H9NO2/c1-13-9-4-2-3-7-5-8(6-12)11-10(7)9/h2-6,11H,1H3
InChI Key:
GNXQSRRPZKDXHA-UHFFFAOYSA-N
SMILES:
COc1cccc2c1[nH]c(c2)C=O
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.063g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.187g/mol
Monoisotopic Mass:
175.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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