Home Carboxys methyl 1-amino-4,4-difluorocyclohexane-1-carboxylate

methyl 1-amino-4,4-difluorocyclohexane-1-carboxylate

CAS No.:
885498-55-5
Catalog Number:
AG00IL07
Molecular Formula:
C8H13F2NO2
Molecular Weight:
193.1911
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$577
- +
5g
97%
1 week
United States
$1655
- +
Product Description
Catalog Number:
AG00IL07
Chemical Name:
methyl 1-amino-4,4-difluorocyclohexane-1-carboxylate
CAS Number:
885498-55-5
Molecular Formula:
C8H13F2NO2
Molecular Weight:
193.1911
MDL Number:
MFCD28016285
IUPAC Name:
methyl 1-amino-4,4-difluorocyclohexane-1-carboxylate
InChI:
InChI=1S/C8H13F2NO2/c1-13-6(12)7(11)2-4-8(9,10)5-3-7/h2-5,11H2,1H3
InChI Key:
MXZJFANNNXYGJK-UHFFFAOYSA-N
SMILES:
COC(=O)C1(N)CCC(CC1)(F)F
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.091g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.194g/mol
Monoisotopic Mass:
193.091g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties