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pentane-1,2-diamine

CAS No.:
52940-41-7
Catalog Number:
AG019X3U
Molecular Formula:
C5H14N2
Molecular Weight:
102.1781
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Product Description
Catalog Number:
AG019X3U
Chemical Name:
pentane-1,2-diamine
CAS Number:
52940-41-7
Molecular Formula:
C5H14N2
Molecular Weight:
102.1781
MDL Number:
MFCD12190269
IUPAC Name:
pentane-1,2-diamine
InChI:
InChI=1S/C5H14N2/c1-2-3-5(7)4-6/h5H,2-4,6-7H2,1H3
InChI Key:
LPGZAWSMGCIBOF-UHFFFAOYSA-N
SMILES:
CCCC(CN)N
Properties
Complexity:
37.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
102.116g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
102.181g/mol
Monoisotopic Mass:
102.116g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Literature
Title Journal
[Determination of 20 kinds of pesticide residues in soybeans and corn using gas chromatography-negative chemical ionization mass spectrometry coupled with offline disperse solid-phase extraction]. Se pu = Chinese journal of chromatography 20090301
Properties