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87623-94-7

87623-94-7 | 1H-Indole, 1-acetyloctahydro-2-methoxy-

CAS No: 87623-94-7 Catalog No: AG004HWA MDL No:

Product Description

Catalog Number:
AG004HWA
Chemical Name:
1H-Indole, 1-acetyloctahydro-2-methoxy-
CAS Number:
87623-94-7
Molecular Formula:
C11H19NO2
Molecular Weight:
197.2741
IUPAC Name:
1-(2-methoxy-2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)ethanone
InChI:
InChI=1S/C11H19NO2/c1-8(13)12-10-6-4-3-5-9(10)7-11(12)14-2/h9-11H,3-7H2,1-2H3
InChI Key:
VWFZUFMXKIPOFR-UHFFFAOYSA-N
SMILES:
COC1CC2C(N1C(=O)C)CCCC2

Properties

Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.142g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.278g/mol
Monoisotopic Mass:
197.142g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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