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102450-00-0,MFCD07772984
Catalog No.:AA0007FW
102450-00-0 | 2-(2-Methylcyclohexyl)ethan-1-amine
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Technical Information
Catalog Number:
AA0007FW
Chemical Name:
2-(2-Methylcyclohexyl)ethan-1-amine
CAS Number:
102450-00-0
Molecular Formula:
C9H19N
Molecular Weight:
141.2539
MDL Number:
MFCD07772984
IUPAC Name:
2-(2-methylcyclohexyl)ethanamine
InChI:
InChI=1S/C9H19N/c1-8-4-2-3-5-9(8)6-7-10/h8-9H,2-7,10H2,1H3
InChI Key:
BXKLFCREVJPUJY-UHFFFAOYSA-N
SMILES:
NCCC1CCCCC1C
Properties
Computed Properties
 
Complexity:
90.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.152g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
141.258g/mol
Monoisotopic Mass:
141.152g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

Synonyms
 
102450-00-0 
2-(2-methylcyclohexyl)ethan-1-amine 
NE40749 
2-(2-METHYL-CYCLOHEXYL)-ETHYLAMINE 
EN300-77468 
K(BIOTIN)-RFARKGSLRQKNV 
2-(2-METHYLCYCLOHEXYL)ETHANAMINE 
Cyclohexaneethanamine,2-methyl- 
ACMC-1CB0X 
SCHEMBL1755688 
CTK4A1108 
Cyclohexaneethanamine, 2-methyl- 
DTXSID00692904 
AKOS010970140 
Literature
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