Home Aminos 3,4-diaminobutan-1-ol

3,4-diaminobutan-1-ol

CAS No.:
98021-21-7
Catalog Number:
AG01AKKR
Molecular Formula:
C4H12N2O
Molecular Weight:
104.1509
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Product Description
Catalog Number:
AG01AKKR
Chemical Name:
3,4-diaminobutan-1-ol
CAS Number:
98021-21-7
Molecular Formula:
C4H12N2O
Molecular Weight:
104.1509
MDL Number:
MFCD19206877
IUPAC Name:
3,4-diaminobutan-1-ol
InChI:
InChI=1S/C4H12N2O/c5-3-4(6)1-2-7/h4,7H,1-3,5-6H2
InChI Key:
WIYMETYMVDXKRR-UHFFFAOYSA-N
SMILES:
OCCC(CN)N
Properties
Complexity:
40.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
104.095g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
104.153g/mol
Monoisotopic Mass:
104.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.9  
Properties