Home Carbonyls 2-((tert-Butoxycarbonyl)amino)-3-(3,3-difluorocyclobutyl)propanoic acid

2-((tert-Butoxycarbonyl)amino)-3-(3,3-difluorocyclobutyl)propanoic acid

CAS No.:
681128-43-8
Catalog Number:
AG00IBSJ
Molecular Formula:
C12H19F2NO4
Molecular Weight:
279.2804
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$328
- +
250mg
97%
1 week
United States
$523
- +
1g
97%
1 week
United States
$1494
- +
Product Description
Catalog Number:
AG00IBSJ
Chemical Name:
2-((tert-Butoxycarbonyl)amino)-3-(3,3-difluorocyclobutyl)propanoic acid
CAS Number:
681128-43-8
Molecular Formula:
C12H19F2NO4
Molecular Weight:
279.2804
MDL Number:
MFCD28501989
IUPAC Name:
3-(3,3-difluorocyclobutyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI:
InChI=1S/C12H19F2NO4/c1-11(2,3)19-10(18)15-8(9(16)17)4-7-5-12(13,14)6-7/h7-8H,4-6H2,1-3H3,(H,15,18)(H,16,17)
InChI Key:
FZKXCGBTNRNDOX-UHFFFAOYSA-N
SMILES:
OC(=O)C(NC(=O)OC(C)(C)C)CC1CC(C1)(F)F
Properties
Complexity:
357  
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:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties