Home Aminos 4-amino-2,2-dimethylbutane-1,3-diol

4-amino-2,2-dimethylbutane-1,3-diol

CAS No.:
1824360-28-2
Catalog Number:
AG01EJ7Q
Molecular Formula:
C6H15NO2
Molecular Weight:
133.1888
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Product Description
Catalog Number:
AG01EJ7Q
Chemical Name:
4-amino-2,2-dimethylbutane-1,3-diol
CAS Number:
1824360-28-2
Molecular Formula:
C6H15NO2
Molecular Weight:
133.1888
MDL Number:
MFCD22412694
IUPAC Name:
4-amino-2,2-dimethylbutane-1,3-diol
InChI:
InChI=1S/C6H15NO2/c1-6(2,4-8)5(9)3-7/h5,8-9H,3-4,7H2,1-2H3
InChI Key:
YWLIRIZEWAOJDT-UHFFFAOYSA-N
SMILES:
NCC(C(CO)(C)C)O
Properties
Complexity:
83.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.11g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
133.191g/mol
Monoisotopic Mass:
133.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties