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40496-46-6

40496-46-6 | 2,3,4,5,6,11-hexahydro-1h-1,5-methanoazocino[3,4-b]indole

CAS No: 40496-46-6 Catalog No: AG0076Z5 MDL No:

Product Description

Catalog Number:
AG0076Z5
Chemical Name:
2,3,4,5,6,11-hexahydro-1h-1,5-methanoazocino[3,4-b]indole
CAS Number:
40496-46-6
Molecular Formula:
C14H16N2
Molecular Weight:
212.2902
IUPAC Name:
3,15-diazatetracyclo[10.3.1.02,10.04,9]hexadeca-2(10),4,6,8-tetraene
InChI:
InChI=1S/C14H16N2/c1-2-4-12-10(3-1)11-7-9-5-6-15-13(8-9)14(11)16-12/h1-4,9,13,15-16H,5-8H2
InChI Key:
WUFHXUOYDZXRBB-UHFFFAOYSA-N
SMILES:
C1CC2CC(N1)c1c(C2)c2c([nH]1)cccc2
NSC Number:
149888

Properties

Complexity:
278  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.131g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
212.296g/mol
Monoisotopic Mass:
212.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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