200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 88880-83-5
88880-83-5 | 2,4-Diazabicyclo[3.3.1]non-2-ene, 9-methyl-3-phenyl-
CAS No: 88880-83-5 Catalog No: AG0049JJ MDL No:
Product Description
Catalog Number:
AG0049JJ
Chemical Name:
2,4-Diazabicyclo[3.3.1]non-2-ene, 9-methyl-3-phenyl-
CAS Number:
88880-83-5
Molecular Formula:
C14H18N2
Molecular Weight:
214.3061
IUPAC Name:
9-methyl-3-phenyl-2,4-diazabicyclo[3.3.1]non-2-ene
InChI:
InChI=1S/C14H18N2/c1-10-12-8-5-9-13(10)16-14(15-12)11-6-3-2-4-7-11/h2-4,6-7,10,12-13H,5,8-9H2,1H3,(H,15,16)
InChI Key:
DVCOVCNLCJSEBZ-UHFFFAOYSA-N
SMILES:
CC1C2CCCC1N=C(N2)c1ccccc1
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.147g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.312g/mol
Monoisotopic Mass:
214.147g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
24.4A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.