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101564-20-9 | Cyclohexanecarboxamide, N-(2-bromo-2-propen-1-yl)-
CAS No: 101564-20-9 Catalog No: AG0004TC MDL No:
Product Description
Catalog Number:
AG0004TC
Chemical Name:
Cyclohexanecarboxamide, N-(2-bromo-2-propen-1-yl)-
CAS Number:
101564-20-9
Molecular Formula:
C10H16BrNO
Molecular Weight:
246.1441
IUPAC Name:
N-(2-bromoprop-2-enyl)cyclohexanecarboxamide
InChI:
InChI=1S/C10H16BrNO/c1-8(11)7-12-10(13)9-5-3-2-4-6-9/h9H,1-7H2,(H,12,13)
InChI Key:
SLUYDJPXDLADFL-UHFFFAOYSA-N
SMILES:
O=C(C1CCCCC1)NCC(=C)Br
NSC Number:
172311
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.042g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.148g/mol
Monoisotopic Mass:
245.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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