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Home > Aldehydes > 123731-75-9
123731-75-9 | 1H-Indole-2-carboxaldehyde, 3-methyl-1-(2-propen-1-yl)-
CAS No: 123731-75-9 Catalog No: AG000L01 MDL No:
Product Description
Catalog Number:
AG000L01
Chemical Name:
1H-Indole-2-carboxaldehyde, 3-methyl-1-(2-propen-1-yl)-
CAS Number:
123731-75-9
Molecular Formula:
C13H13NO
Molecular Weight:
199.2484
IUPAC Name:
3-methyl-1-prop-2-enylindole-2-carbaldehyde
InChI:
InChI=1S/C13H13NO/c1-3-8-14-12-7-5-4-6-11(12)10(2)13(14)9-15/h3-7,9H,1,8H2,2H3
InChI Key:
UDZUMZLCDICZSW-UHFFFAOYSA-N
SMILES:
C=CCn1c2ccccc2c(c1C=O)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.1g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.253g/mol
Monoisotopic Mass:
199.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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