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123-82-0

123-82-0 | 2-Heptanamine

CAS No: 123-82-0 Catalog No: AG000JXT MDL No:MFCD00008101

Product Description

Catalog Number:
AG000JXT
Chemical Name:
2-Heptanamine
CAS Number:
123-82-0
Molecular Formula:
C7H17N
Molecular Weight:
115.2166
MDL Number:
MFCD00008101
IUPAC Name:
heptan-2-amine
InChI:
InChI=1S/C7H17N/c1-3-4-5-6-7(2)8/h7H,3-6,8H2,1-2H3
InChI Key:
VSRBKQFNFZQRBM-UHFFFAOYSA-N
SMILES:
CCCCCC(N)C
EC Number:
204-655-5

Properties

Complexity:
43.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.136g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
115.22g/mol
Monoisotopic Mass:
115.136g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Literature

Title Journal
Controlling cell growth on titanium by surface functionalization of heptylamine using a novel combined plasma polymerization mode. Journal of biomedical materials research. Part A 20110501
Detection in urine of 4-methyl-2-hexaneamine, a doping agent. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20091101
The amine-containing cutaneous irritant heptylamine inhibits the volume-regulated anion channel and mobilizes intracellular calcium in normal human epidermal keratinocytes. Molecular pharmacology 20070601
Determination of tuaminoheptane in doping control urine samples. European journal of mass spectrometry (Chichester, England) 20070101

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