Home Carboxys 3-[(tert-Butoxycarbonyl)amino]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

3-[(tert-Butoxycarbonyl)amino]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

CAS No.:
148257-14-1
Catalog Number:
AG001FK6
Molecular Formula:
C12H17NO5
Molecular Weight:
255.2671
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
In Stock USA
United States
$130
- +
500mg
In Stock USA
United States
$221
- +
1g
In Stock USA
United States
$401
- +
2.5g
In Stock USA
United States
$880
- +
5g
In Stock USA
United States
$1616
- +
Product Description
Catalog Number:
AG001FK6
Chemical Name:
3-[(tert-Butoxycarbonyl)amino]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CAS Number:
148257-14-1
Molecular Formula:
C12H17NO5
Molecular Weight:
255.2671
MDL Number:
MFCD07783749
IUPAC Name:
(1R,2S,3R,4S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
InChI:
InChI=1S/C12H17NO5/c1-12(2,3)18-11(16)13-9-7-5-4-6(17-7)8(9)10(14)15/h4-9H,1-3H3,(H,13,16)(H,14,15)/t6-,7+,8-,9+/m1/s1
InChI Key:
BDISLHPIKVZWDN-XAVMHZPKSA-N
SMILES:
O=C(OC(C)(C)C)N[C@H]1[C@@H]2C=C[C@H]([C@H]1C(=O)O)O2
Properties
Complexity:
398  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
255.111g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.27g/mol
Monoisotopic Mass:
255.111g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties