Home Other Building Blocks 3-methylbutane-1,3-diamine dihydrochloride

3-methylbutane-1,3-diamine dihydrochloride

CAS No.:
100516-73-2
Catalog Number:
AG01AMTD
Molecular Formula:
C5H16Cl2N2
Molecular Weight:
175.0999
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Product Description
Catalog Number:
AG01AMTD
Chemical Name:
3-methylbutane-1,3-diamine dihydrochloride
CAS Number:
100516-73-2
Molecular Formula:
C5H16Cl2N2
Molecular Weight:
175.0999
MDL Number:
MFCD29034010
IUPAC Name:
3-methylbutane-1,3-diamine;dihydrochloride
InChI:
InChI=1S/C5H14N2.2ClH/c1-5(2,7)3-4-6;;/h3-4,6-7H2,1-2H3;2*1H
InChI Key:
GJMKAYUUKYWLAE-UHFFFAOYSA-N
SMILES:
NCCC(N)(C)C.Cl.Cl
Properties
Complexity:
50  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.069g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
175.097g/mol
Monoisotopic Mass:
174.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties