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2364-78-5 | Propanamide, 3-chloro-N-[(4-propoxyphenyl)methyl]-
CAS No: 2364-78-5 Catalog No: AG002NZW MDL No:
Product Description
Catalog Number:
AG002NZW
Chemical Name:
Propanamide, 3-chloro-N-[(4-propoxyphenyl)methyl]-
CAS Number:
2364-78-5
Molecular Formula:
C13H18ClNO2
Molecular Weight:
255.7405
IUPAC Name:
3-chloro-N-[(4-propoxyphenyl)methyl]propanamide
InChI:
InChI=1S/C13H18ClNO2/c1-2-9-17-12-5-3-11(4-6-12)10-15-13(16)7-8-14/h3-6H,2,7-10H2,1H3,(H,15,16)
InChI Key:
JVEBLFYMCGKSIK-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1)CNC(=O)CCCl
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.103g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.742g/mol
Monoisotopic Mass:
255.103g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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