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358641-81-3 | 1H-Benz[g]indole-2-carboxaldehyde, 4,5-dihydro-
CAS No: 358641-81-3 Catalog No: AG007EBN MDL No:
Product Description
Catalog Number:
AG007EBN
Chemical Name:
1H-Benz[g]indole-2-carboxaldehyde, 4,5-dihydro-
CAS Number:
358641-81-3
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
IUPAC Name:
4,5-dihydro-1H-benzo[g]indole-2-carbaldehyde
InChI:
InChI=1S/C13H11NO/c15-8-11-7-10-6-5-9-3-1-2-4-12(9)13(10)14-11/h1-4,7-8,14H,5-6H2
InChI Key:
NLQCGLVXWGREFI-UHFFFAOYSA-N
SMILES:
O=Cc1cc2c([nH]1)c1ccccc1CC2
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.237g/mol
Monoisotopic Mass:
197.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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