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Home > Aldehydes > 918811-75-3
918811-75-3 | Benzaldehyde, 3-[bis(phenylmethyl)amino]-4-fluoro-
CAS No: 918811-75-3 Catalog No: AG006NT1 MDL No:
Product Description
Catalog Number:
AG006NT1
Chemical Name:
Benzaldehyde, 3-[bis(phenylmethyl)amino]-4-fluoro-
CAS Number:
918811-75-3
Molecular Formula:
C21H18FNO
Molecular Weight:
319.3721
IUPAC Name:
3-(dibenzylamino)-4-fluorobenzaldehyde
InChI:
InChI=1S/C21H18FNO/c22-20-12-11-19(16-24)13-21(20)23(14-17-7-3-1-4-8-17)15-18-9-5-2-6-10-18/h1-13,16H,14-15H2
InChI Key:
NKVYNUMGZOOKSV-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)N(Cc1ccccc1)Cc1ccccc1)F
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.137g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.379g/mol
Monoisotopic Mass:
319.137g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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