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821780-00-1 | Formamide, N-(4-chlorophenyl)-N-[3-[(1,1-dimethylethyl)amino]propyl]-
CAS No: 821780-00-1 Catalog No: AG0057UR MDL No:
Product Description
Catalog Number:
AG0057UR
Chemical Name:
Formamide, N-(4-chlorophenyl)-N-[3-[(1,1-dimethylethyl)amino]propyl]-
CAS Number:
821780-00-1
Molecular Formula:
C14H21ClN2O
Molecular Weight:
268.7823
IUPAC Name:
N-[3-(tert-butylamino)propyl]-N-(4-chlorophenyl)formamide
InChI:
InChI=1S/C14H21ClN2O/c1-14(2,3)16-9-4-10-17(11-18)13-7-5-12(15)6-8-13/h5-8,11,16H,4,9-10H2,1-3H3
InChI Key:
BKNVTAUAYDQDLZ-UHFFFAOYSA-N
SMILES:
O=CN(c1ccc(cc1)Cl)CCCNC(C)(C)C
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.134g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
268.785g/mol
Monoisotopic Mass:
268.134g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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