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Home > Other Heterocycles > 52378-83-3
52378-83-3 | 7-Azabicyclo[4.1.0]hept-2-ene, 2,4,4-trimethyl-
CAS No: 52378-83-3 Catalog No: AG006UGB MDL No:
Product Description
Catalog Number:
AG006UGB
Chemical Name:
7-Azabicyclo[4.1.0]hept-2-ene, 2,4,4-trimethyl-
CAS Number:
52378-83-3
Molecular Formula:
C9H15N
Molecular Weight:
137.2221
IUPAC Name:
2,4,4-trimethyl-7-azabicyclo[4.1.0]hept-2-ene
InChI:
InChI=1S/C9H15N/c1-6-4-9(2,3)5-7-8(6)10-7/h4,7-8,10H,5H2,1-3H3
InChI Key:
OJDCHYXGVDDATP-UHFFFAOYSA-N
SMILES:
CC1=CC(C)(C)CC2C1N2
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.12g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
137.226g/mol
Monoisotopic Mass:
137.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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