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87167-64-4 | 1H-Carbazole-1-carboxaldehyde, 2,3,4,9-tetrahydro-9-(phenylmethyl)-
CAS No: 87167-64-4 Catalog No: AG004OAZ MDL No:
Product Description
Catalog Number:
AG004OAZ
Chemical Name:
1H-Carbazole-1-carboxaldehyde, 2,3,4,9-tetrahydro-9-(phenylmethyl)-
CAS Number:
87167-64-4
Molecular Formula:
C20H19NO
Molecular Weight:
289.3710
IUPAC Name:
9-benzyl-1,2,3,4-tetrahydrocarbazole-1-carbaldehyde
InChI:
InChI=1S/C20H19NO/c22-14-16-9-6-11-18-17-10-4-5-12-19(17)21(20(16)18)13-15-7-2-1-3-8-15/h1-5,7-8,10,12,14,16H,6,9,11,13H2
InChI Key:
KREFCFTUZGOKOU-UHFFFAOYSA-N
SMILES:
O=CC1CCCc2c1n(Cc1ccccc1)c1c2cccc1
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.147g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.378g/mol
Monoisotopic Mass:
289.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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