Home Other Building Blocks 1-BUTANOL-1,1,2,2-D4

1-BUTANOL-1,1,2,2-D4

CAS No.:
118104-91-9
Catalog Number:
AG008T0N
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG008T0N
Chemical Name:
1-BUTANOL-1,1,2,2-D4
CAS Number:
118104-91-9
MDL Number:
MFCD03428310
IUPAC Name:
1,1,2,2-tetradeuteriobutan-1-ol
InChI:
InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3/i3D2,4D2
InChI Key:
LRHPLDYGYMQRHN-KHORGVISSA-N
Properties
Complexity:
13.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
78.098g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
4  
Molecular Weight:
78.147g/mol
Monoisotopic Mass:
78.098g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties