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50669-77-7

50669-77-7 | 2-methyl-octahydro-1H-indole

CAS No: 50669-77-7 Catalog No: AG01AHKT MDL No:MFCD19216499

Product Description

Catalog Number:
AG01AHKT
Chemical Name:
2-methyl-octahydro-1H-indole
CAS Number:
50669-77-7
Molecular Formula:
C9H17N
Molecular Weight:
139.2380
MDL Number:
MFCD19216499
IUPAC Name:
2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole
InChI:
InChI=1S/C9H17N/c1-7-6-8-4-2-3-5-9(8)10-7/h7-10H,2-6H2,1H3
InChI Key:
ZJHBAERTGJSGHX-UHFFFAOYSA-N
SMILES:
CC1CC2C(N1)CCCC2

Properties

Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.136g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
139.242g/mol
Monoisotopic Mass:
139.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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