Home Carboxys 1-(tert-Butoxycarbonylamino)-4,4-difluorocyclohexanecarboxylic acid

1-(tert-Butoxycarbonylamino)-4,4-difluorocyclohexanecarboxylic acid

CAS No.:
1196151-58-2
Catalog Number:
AG000PAH
Molecular Formula:
C12H19F2NO4
Molecular Weight:
279.2804
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$173
- +
250mg
97%
1 week
United States
$307
- +
1g
97%
1 week
United States
$712
- +
5g
97%
1 week
United States
$2059
- +
10g
97%
1 week
United States
$3406
- +
25g
97%
1 week
United States
$6774
- +
Product Description
Catalog Number:
AG000PAH
Chemical Name:
1-(tert-Butoxycarbonylamino)-4,4-difluorocyclohexanecarboxylic acid
CAS Number:
1196151-58-2
Molecular Formula:
C12H19F2NO4
Molecular Weight:
279.2804
MDL Number:
MFCD13189566
IUPAC Name:
4,4-difluoro-1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C12H19F2NO4/c1-10(2,3)19-9(18)15-11(8(16)17)4-6-12(13,14)7-5-11/h4-7H2,1-3H3,(H,15,18)(H,16,17)
InChI Key:
DNCLYQBHWODZAX-UHFFFAOYSA-N
SMILES:
O=C(NC1(CCC(CC1)(F)F)C(=O)O)OC(C)(C)C
Properties
Complexity:
366  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.128g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
279.284g/mol
Monoisotopic Mass:
279.128g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties