200,000+ products from a single source!
sales@angenechem.com
7525-46-4 | 2-methyl-1,2,3,4-tetrahydro-1,4-methanonaphthalen-2-yl 4-nitrobenzoate
CAS No: 7525-46-4 Catalog No: AG005CM3 MDL No:
Product Description
Catalog Number:
AG005CM3
Chemical Name:
2-methyl-1,2,3,4-tetrahydro-1,4-methanonaphthalen-2-yl 4-nitrobenzoate
CAS Number:
7525-46-4
Molecular Formula:
C19H17NO4
Molecular Weight:
323.3426
IUPAC Name:
(9-methyl-9-tricyclo[6.2.1.02,7]undeca-2,4,6-trienyl) 4-nitrobenzoate
InChI:
InChI=1S/C19H17NO4/c1-19(11-13-10-17(19)16-5-3-2-4-15(13)16)24-18(21)12-6-8-14(9-7-12)20(22)23/h2-9,13,17H,10-11H2,1H3
InChI Key:
KYZCCAROKGUPKK-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)[N+](=O)[O-])OC1(C)CC2CC1c1c2cccc1
NSC Number:
102278
Properties
Complexity:
522
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.116g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.348g/mol
Monoisotopic Mass:
323.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.