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20589-08-6

20589-08-6 | 10H-Azepino[1,2-a]indole

CAS No: 20589-08-6 Catalog No: AG002AEZ MDL No:

Product Description

Catalog Number:
AG002AEZ
Chemical Name:
10H-Azepino[1,2-a]indole
CAS Number:
20589-08-6
Molecular Formula:
C13H11N
Molecular Weight:
181.2331
IUPAC Name:
10H-azepino[1,2-a]indole
InChI:
InChI=1S/C13H11N/c1-2-7-12-10-11-6-3-4-8-13(11)14(12)9-5-1/h1-6,8-10H,7H2
InChI Key:
OXBLTKUMOXNFOO-UHFFFAOYSA-N
SMILES:
C1=CCc2n(C=C1)c1c(c2)cccc1

Properties

Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.089g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.238g/mol
Monoisotopic Mass:
181.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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