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88702-22-1 | Acetamide, N-[2,5-bis(1-methylethyl)phenyl]-
CAS No: 88702-22-1 Catalog No: AG0047F4 MDL No:
Product Description
Catalog Number:
AG0047F4
Chemical Name:
Acetamide, N-[2,5-bis(1-methylethyl)phenyl]-
CAS Number:
88702-22-1
Molecular Formula:
C14H21NO
Molecular Weight:
219.3226
IUPAC Name:
N-[2,5-di(propan-2-yl)phenyl]acetamide
InChI:
InChI=1S/C14H21NO/c1-9(2)12-6-7-13(10(3)4)14(8-12)15-11(5)16/h6-10H,1-5H3,(H,15,16)
InChI Key:
ZGFKRBYYODMZAJ-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(ccc1C(C)C)C(C)C
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.162g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.328g/mol
Monoisotopic Mass:
219.162g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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