Home Other Building Blocks 4-methylpentane-1,2-diamine

4-methylpentane-1,2-diamine

CAS No.:
156428-49-8
Catalog Number:
AG01AH6Z
Molecular Formula:
C6H16N2
Molecular Weight:
116.2046
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Product Description
Catalog Number:
AG01AH6Z
Chemical Name:
4-methylpentane-1,2-diamine
CAS Number:
156428-49-8
Molecular Formula:
C6H16N2
Molecular Weight:
116.2046
MDL Number:
MFCD12190271
IUPAC Name:
4-methylpentane-1,2-diamine
InChI:
InChI=1S/C6H16N2/c1-5(2)3-6(8)4-7/h5-6H,3-4,7-8H2,1-2H3
InChI Key:
LGNSOKKCXYBTOL-UHFFFAOYSA-N
SMILES:
NCC(CC(C)C)N
Properties
Complexity:
52.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.131g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
116.208g/mol
Monoisotopic Mass:
116.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
Cicadapeptins I and II: new Aib-containing peptides from the entomopathogenic fungus Cordyceps heteropoda. Journal of natural products 20050101
Properties