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88141-74-6 | Propanamide, 3-chloro-N-[(4-hydroxy-3-methoxyphenyl)methyl]-
CAS No: 88141-74-6 Catalog No: AG004F1U MDL No:
Product Description
Catalog Number:
AG004F1U
Chemical Name:
Propanamide, 3-chloro-N-[(4-hydroxy-3-methoxyphenyl)methyl]-
CAS Number:
88141-74-6
Molecular Formula:
C11H14ClNO3
Molecular Weight:
243.6868
IUPAC Name:
3-chloro-N-[(4-hydroxy-3-methoxyphenyl)methyl]propanamide
InChI:
InChI=1S/C11H14ClNO3/c1-16-10-6-8(2-3-9(10)14)7-13-11(15)4-5-12/h2-3,6,14H,4-5,7H2,1H3,(H,13,15)
InChI Key:
XJBOZELVTUTMRZ-UHFFFAOYSA-N
SMILES:
ClCCC(=O)NCc1ccc(c(c1)OC)O
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.066g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
243.687g/mol
Monoisotopic Mass:
243.066g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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