Home Carboxys Rac-(1s,5r,6s,7r)-3-methyl-4-oxo-10-oxa-3-azatricyclo[5.2.1.0(1,5)]dec-8-ene-6-carboxylic acid

Rac-(1s,5r,6s,7r)-3-methyl-4-oxo-10-oxa-3-azatricyclo[5.2.1.0(1,5)]dec-8-ene-6-carboxylic acid

CAS No.:
1820576-25-7
Catalog Number:
AG00J2LF
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
- +
5g
95%
In Stock USA
United States
$1136
- +
Product Description
Catalog Number:
AG00J2LF
Chemical Name:
Rac-(1s,5r,6s,7r)-3-methyl-4-oxo-10-oxa-3-azatricyclo[5.2.1.0(1,5)]dec-8-ene-6-carboxylic acid
CAS Number:
1820576-25-7
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
MDL Number:
MFCD18917072
IUPAC Name:
(1S,5R,6S,7R)-3-methyl-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-6-carboxylic acid
InChI:
InChI=1S/C10H11NO4/c1-11-4-10-3-2-5(15-10)6(9(13)14)7(10)8(11)12/h2-3,5-7H,4H2,1H3,(H,13,14)/t5-,6-,7+,10-/m1/s1
InChI Key:
DSGNMFPBRAMEKL-QGOVLLJGSA-N
SMILES:
OC(=O)[C@@H]1[C@H]2C=C[C@@]3([C@@H]1C(=O)N(C3)C)O2
Properties
Complexity:
391  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
209.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.201g/mol
Monoisotopic Mass:
209.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Properties