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1184804-60-1 | 2-Chloro-N-isopropyl-N-pyridin-3-ylmethyl-acetamide
CAS No: 1184804-60-1 Catalog No: AG01F8OM MDL No:
Product Description
Catalog Number:
AG01F8OM
Chemical Name:
2-Chloro-N-isopropyl-N-pyridin-3-ylmethyl-acetamide
CAS Number:
1184804-60-1
Molecular Formula:
C11H15ClN2O
Molecular Weight:
226.7026
IUPAC Name:
2-chloro-N-propan-2-yl-N-(pyridin-3-ylmethyl)acetamide
InChI:
InChI=1S/C11H15ClN2O/c1-9(2)14(11(15)6-12)8-10-4-3-5-13-7-10/h3-5,7,9H,6,8H2,1-2H3
InChI Key:
GROOMFHGNUWYNY-UHFFFAOYSA-N
SMILES:
ClCC(=O)N(C(C)C)Cc1cccnc1
Properties
Complexity:
209
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:
0
Isotope Atom Count:
0
Molecular Weight:
226.704g/mol
Monoisotopic Mass:
226.087g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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