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1181696-89-8 | 2-Chloro-N-isopropyl-N-(3-methyl-benzyl)-acetamide
CAS No: 1181696-89-8 Catalog No: AG01F8Y3 MDL No:
Product Description
Catalog Number:
AG01F8Y3
Chemical Name:
2-Chloro-N-isopropyl-N-(3-methyl-benzyl)-acetamide
CAS Number:
1181696-89-8
Molecular Formula:
C13H18ClNO
Molecular Weight:
239.7411
IUPAC Name:
2-chloro-N-[(3-methylphenyl)methyl]-N-propan-2-ylacetamide
InChI:
InChI=1S/C13H18ClNO/c1-10(2)15(13(16)8-14)9-12-6-4-5-11(3)7-12/h4-7,10H,8-9H2,1-3H3
InChI Key:
UWKZIBSCNGCSSU-UHFFFAOYSA-N
SMILES:
ClCC(=O)N(C(C)C)Cc1cccc(c1)C
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.108g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.743g/mol
Monoisotopic Mass:
239.108g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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