200,000+ products from a single source!
sales@angenechem.com
136471-32-4 | Furo[2,3-b]quinoxaline-3-carboxylic acid, 3a,4,9,9a-tetrahydro-2,9-dimethyl-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester
CAS No: 136471-32-4 Catalog No: AG0011W9 MDL No:
Product Description
Catalog Number:
AG0011W9
Chemical Name:
Furo[2,3-b]quinoxaline-3-carboxylic acid, 3a,4,9,9a-tetrahydro-2,9-dimethyl-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester
CAS Number:
136471-32-4
Molecular Formula:
C23H30N2O3
Molecular Weight:
382.4959
IUPAC Name:
(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) 2,9-dimethyl-4,9a-dihydro-3aH-furo[3,2-b]quinoxaline-3-carboxylate
InChI:
InChI=1S/C23H30N2O3/c1-13-18(19-20(27-13)25(5)16-9-7-6-8-15(16)24-19)21(26)28-17-12-14-10-11-23(17,4)22(14,2)3/h6-9,14,17,19-20,24H,10-12H2,1-5H3
InChI Key:
DZCIUYJBFWBQJD-UHFFFAOYSA-N
SMILES:
O=C(C1=C(C)OC2C1Nc1ccccc1N2C)OC1CC2C(C1(C)CC2)(C)C
Properties
Complexity:
717
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.226g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
382.504g/mol
Monoisotopic Mass:
382.226g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.