200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1441-56-1
1441-56-1 | 1,3-Butadiene-1,1,2,3,4,4-d6 (8CI,9CI)
CAS No: 1441-56-1 Catalog No: AG001IXD MDL No:
Product Description
Catalog Number:
AG001IXD
Chemical Name:
1,3-Butadiene-1,1,2,3,4,4-d6 (8CI,9CI)
CAS Number:
1441-56-1
Molecular Formula:
C4D6
Molecular Weight:
60.1274
IUPAC Name:
1,1,2,3,4,4-hexadeuteriobuta-1,3-diene
InChI:
InChI=1S/C4H6/c1-3-4-2/h3-4H,1-2H2/i1D2,2D2,3D,4D
InChI Key:
KAKZBPTYRLMSJV-UFSLNRCZSA-N
SMILES:
C(=C(C(=C([2H])[2H])[2H])[2H])([2H])[2H]
Properties
Complexity:
21
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
60.085g/mol
Formal Charge:
0
Heavy Atom Count:
4
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
6
Molecular Weight:
60.129g/mol
Monoisotopic Mass:
60.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Vibrational modes of the vinyl and deuterated vinyl radicals. | The journal of physical chemistry. A 20090806 |
| Formation and reaction of hydroxycarbonyls from the reaction of OH radicals with 1,3-butadiene and isoprene. | Environmental science & technology 20050601 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.