Home Carboxys 5-(tert-Butoxycarbonylamino-methyl)cyclohex-1-enecarboxylic acid

5-(tert-Butoxycarbonylamino-methyl)cyclohex-1-enecarboxylic acid

CAS No.:
1434141-75-9
Catalog Number:
AG00HWWF
Molecular Formula:
C13H21NO4
Molecular Weight:
255.3101
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$199
- +
250mg
97%
1 week
United States
$307
- +
1g
97%
1 week
United States
$832
- +
Product Description
Catalog Number:
AG00HWWF
Chemical Name:
5-(tert-Butoxycarbonylamino-methyl)cyclohex-1-enecarboxylic acid
CAS Number:
1434141-75-9
Molecular Formula:
C13H21NO4
Molecular Weight:
255.3101
MDL Number:
MFCD26959107
IUPAC Name:
5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexene-1-carboxylic acid
InChI:
InChI=1S/C13H21NO4/c1-13(2,3)18-12(17)14-8-9-5-4-6-10(7-9)11(15)16/h6,9H,4-5,7-8H2,1-3H3,(H,14,17)(H,15,16)
InChI Key:
FGTWYUSFTOAPBY-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCC1CCC=C(C1)C(=O)O
Properties
Complexity:
355  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.147g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.314g/mol
Monoisotopic Mass:
255.147g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties