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Home > Aldehydes > 672903-44-5
672903-44-5 | 1H-Indole-2-carboxaldehyde, 1-[2-(1-cyclohexen-1-yl)ethyl]-
CAS No: 672903-44-5 Catalog No: AG006INO MDL No:
Product Description
Catalog Number:
AG006INO
Chemical Name:
1H-Indole-2-carboxaldehyde, 1-[2-(1-cyclohexen-1-yl)ethyl]-
CAS Number:
672903-44-5
Molecular Formula:
C17H19NO
Molecular Weight:
253.3389
IUPAC Name:
1-[2-(cyclohexen-1-yl)ethyl]indole-2-carbaldehyde
InChI:
InChI=1S/C17H19NO/c19-13-16-12-15-8-4-5-9-17(15)18(16)11-10-14-6-2-1-3-7-14/h4-6,8-9,12-13H,1-3,7,10-11H2
InChI Key:
SBQGPOJGCVBDMH-UHFFFAOYSA-N
SMILES:
O=Cc1cc2c(n1CCC1=CCCCC1)cccc2
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.345g/mol
Monoisotopic Mass:
253.147g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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