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138471-98-4 | 5-Decyne, 4,4,7,7-tetramethyl-
CAS No: 138471-98-4 Catalog No: AG00197M MDL No:
Product Description
Catalog Number:
AG00197M
Chemical Name:
5-Decyne, 4,4,7,7-tetramethyl-
CAS Number:
138471-98-4
Molecular Formula:
C14H26
Molecular Weight:
194.3562
IUPAC Name:
4,4,7,7-tetramethyldec-5-yne
InChI:
InChI=1S/C14H26/c1-7-9-13(3,4)11-12-14(5,6)10-8-2/h7-10H2,1-6H3
InChI Key:
DFUVJXJHTOUFKN-UHFFFAOYSA-N
SMILES:
CCCC(C#CC(CCC)(C)C)(C)C
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.203g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.362g/mol
Monoisotopic Mass:
194.203g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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