200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1363210-41-6
1363210-41-6 | 2-Azabicyclo[2.2.1]heptane-2,5-dicarboxylic acid, 2-(1,1-dimethylethyl) ester
CAS No: 1363210-41-6 Catalog No: AG0011N0 MDL No:MFCD22209677
Product Description
Catalog Number:
AG0011N0
Chemical Name:
2-Azabicyclo[2.2.1]heptane-2,5-dicarboxylic acid, 2-(1,1-dimethylethyl) ester
CAS Number:
1363210-41-6
Molecular Formula:
C12H18NO4-
Molecular Weight:
240.2756
MDL Number:
MFCD22209677
IUPAC Name:
2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[2.2.1]heptane-5-carboxylic acid
InChI:
InChI=1S/C12H19NO4/c1-12(2,3)17-11(16)13-6-7-4-8(13)5-9(7)10(14)15/h7-9H,4-6H2,1-3H3,(H,14,15)
InChI Key:
GMGUVTWUHZJSAF-UHFFFAOYSA-N
SMILES:
[O-]C(=O)C1CC2CC1CN2C(=O)OC(C)(C)C
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.131g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.287g/mol
Monoisotopic Mass:
241.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.