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13686-07-2 | Acetamide, 2,2,2-tribromo-N-cyclohexyl-
CAS No: 13686-07-2 Catalog No: AG0012HW MDL No:
Product Description
Catalog Number:
AG0012HW
Chemical Name:
Acetamide, 2,2,2-tribromo-N-cyclohexyl-
CAS Number:
13686-07-2
Molecular Formula:
C8H12Br3NO
Molecular Weight:
377.8990
IUPAC Name:
2,2,2-tribromo-N-cyclohexylacetamide
InChI:
InChI=1S/C8H12Br3NO/c9-8(10,11)7(13)12-6-4-2-1-3-5-6/h6H,1-5H2,(H,12,13)
InChI Key:
OQLGRXIQOBOHQF-UHFFFAOYSA-N
SMILES:
O=C(C(Br)(Br)Br)NC1CCCCC1
NSC Number:
128822
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.845g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
377.902g/mol
Monoisotopic Mass:
374.847g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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