200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 101419-74-3
101419-74-3 | 1-Butanol, 2,2-di(methyl-d3)- (9CI)
CAS No: 101419-74-3 Catalog No: AG0004FV MDL No:
Product Description
Catalog Number:
AG0004FV
Chemical Name:
1-Butanol, 2,2-di(methyl-d3)- (9CI)
CAS Number:
101419-74-3
Molecular Formula:
C6H8D6O
Molecular Weight:
108.2117
IUPAC Name:
2,2-bis(trideuteriomethyl)butan-1-ol
InChI:
InChI=1S/C6H14O/c1-4-6(2,3)5-7/h7H,4-5H2,1-3H3/i2D3,3D3
InChI Key:
XRMVWAKMXZNZIL-XERRXZQWSA-N
SMILES:
CCC(C([2H])([2H])[2H])(C([2H])([2H])[2H])CO
Properties
Complexity:
48.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
108.142g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
6
Molecular Weight:
108.214g/mol
Monoisotopic Mass:
108.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.