Home Other Building Blocks 4-(methylsulfanyl)butane-1,2-diamine dihydrochloride

4-(methylsulfanyl)butane-1,2-diamine dihydrochloride

CAS No.:
1432679-04-3
Catalog Number:
AG01A4CR
Molecular Formula:
C5H16Cl2N2S
Molecular Weight:
207.1649
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Product Description
Catalog Number:
AG01A4CR
Chemical Name:
4-(methylsulfanyl)butane-1,2-diamine dihydrochloride
CAS Number:
1432679-04-3
Molecular Formula:
C5H16Cl2N2S
Molecular Weight:
207.1649
MDL Number:
MFCD23701839
IUPAC Name:
4-methylsulfanylbutane-1,2-diamine;dihydrochloride
InChI:
InChI=1S/C5H14N2S.2ClH/c1-8-3-2-5(7)4-6;;/h5H,2-4,6-7H2,1H3;2*1H
InChI Key:
UONZZHAWPJHPLD-UHFFFAOYSA-N
SMILES:
NCC(CCSC)N.Cl.Cl
Properties
Complexity:
49.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.041g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
207.157g/mol
Monoisotopic Mass:
206.041g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
77.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties