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Home > Aldehydes > 287978-28-3
287978-28-3 | 9H-Carbazole-3-carboxaldehyde, 9-(2-ethylhexyl)-
CAS No: 287978-28-3 Catalog No: AG002WJ1 MDL No:
Product Description
Catalog Number:
AG002WJ1
Chemical Name:
9H-Carbazole-3-carboxaldehyde, 9-(2-ethylhexyl)-
CAS Number:
287978-28-3
Molecular Formula:
C21H25NO
Molecular Weight:
307.4293
IUPAC Name:
9-(2-ethylhexyl)carbazole-3-carbaldehyde
InChI:
InChI=1S/C21H25NO/c1-3-5-8-16(4-2)14-22-20-10-7-6-9-18(20)19-13-17(15-23)11-12-21(19)22/h6-7,9-13,15-16H,3-5,8,14H2,1-2H3
InChI Key:
XLMIVPFPBUWICE-UHFFFAOYSA-N
SMILES:
CCCCC(Cn1c2ccc(cc2c2c1cccc2)C=O)CC
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.194g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.437g/mol
Monoisotopic Mass:
307.194g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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