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20781-87-7 | Acetamide, 2-chloro-N-[2-methyl-6-(1-methylethyl)phenyl]-
CAS No: 20781-87-7 Catalog No: AG002JBG MDL No:MFCD02349107
Product Description
Catalog Number:
AG002JBG
Chemical Name:
Acetamide, 2-chloro-N-[2-methyl-6-(1-methylethyl)phenyl]-
CAS Number:
20781-87-7
Molecular Formula:
C12H16ClNO
Molecular Weight:
225.7145
MDL Number:
MFCD02349107
IUPAC Name:
2-chloro-N-(2-methyl-6-propan-2-ylphenyl)acetamide
InChI:
InChI=1S/C12H16ClNO/c1-8(2)10-6-4-5-9(3)12(10)14-11(15)7-13/h4-6,8H,7H2,1-3H3,(H,14,15)
InChI Key:
MELPBOXLVQNGPR-UHFFFAOYSA-N
SMILES:
ClCC(=O)Nc1c(C)cccc1C(C)C
NSC Number:
622317
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.092g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.716g/mol
Monoisotopic Mass:
225.092g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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