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821779-97-9 | Formamide, N-(4-chlorophenyl)-N-[3-(methylamino)propyl]-
CAS No: 821779-97-9 Catalog No: AG005IT4 MDL No:
Product Description
Catalog Number:
AG005IT4
Chemical Name:
Formamide, N-(4-chlorophenyl)-N-[3-(methylamino)propyl]-
CAS Number:
821779-97-9
Molecular Formula:
C11H15ClN2O
Molecular Weight:
226.7026
IUPAC Name:
N-(4-chlorophenyl)-N-[3-(methylamino)propyl]formamide
InChI:
InChI=1S/C11H15ClN2O/c1-13-7-2-8-14(9-15)11-5-3-10(12)4-6-11/h3-6,9,13H,2,7-8H2,1H3
InChI Key:
CRWIHRDPPQIXAK-UHFFFAOYSA-N
SMILES:
CNCCCN(c1ccc(cc1)Cl)C=O
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.087g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.704g/mol
Monoisotopic Mass:
226.087g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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