200,000+ products from a single source!
sales@angenechem.com
25914-89-0 | Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-, 2,3-bis[(1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-en-2-yl)methyl] ester
CAS No: 25914-89-0 Catalog No: AG002R0F MDL No:
Product Description
Catalog Number:
AG002R0F
Chemical Name:
Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-, 2,3-bis[(1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-en-2-yl)methyl] ester
CAS Number:
25914-89-0
Molecular Formula:
C25H12Cl18O4
Molecular Weight:
1014.5144
IUPAC Name:
bis[(1,4,5,6,7,7-hexachloro-2-bicyclo[2.2.1]hept-5-enyl)methyl] 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate
InChI:
InChI=1S/C25H12Cl18O4/c26-9-11(28)19(34)5(1-17(9,32)23(19,38)39)3-46-15(44)7-8(22(37)14(31)13(30)21(7,36)25(22,42)43)16(45)47-4-6-2-18(33)10(27)12(29)20(6,35)24(18,40)41/h5-8H,1-4H2
InChI Key:
UUPQDYMYZMEINE-UHFFFAOYSA-N
SMILES:
O=C(C1C(C(=O)OCC2CC3(C(C2(Cl)C(=C3Cl)Cl)(Cl)Cl)Cl)C2(C(C1(Cl)C(=C2Cl)Cl)(Cl)Cl)Cl)OCC1CC2(C(C1(Cl)C(=C2Cl)Cl)(Cl)Cl)Cl
NSC Number:
22234
Properties
Complexity:
1510
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1013.501g/mol
Formal Charge:
0
Heavy Atom Count:
47
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
1014.467g/mol
Monoisotopic Mass:
1005.513g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
10
Undefined Bond Stereocenter Count:
0
XLogP3:
9.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.