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100669-80-5 | 3-Decyne, 10-(1,1-dimethylethoxy)-
CAS No: 100669-80-5 Catalog No: AG0002LC MDL No:
Product Description
Catalog Number:
AG0002LC
Chemical Name:
3-Decyne, 10-(1,1-dimethylethoxy)-
CAS Number:
100669-80-5
Molecular Formula:
C14H26O
Molecular Weight:
210.3556
IUPAC Name:
10-[(2-methylpropan-2-yl)oxy]dec-3-yne
InChI:
InChI=1S/C14H26O/c1-5-6-7-8-9-10-11-12-13-15-14(2,3)4/h5,8-13H2,1-4H3
InChI Key:
SSJFMIFRBGVMPH-UHFFFAOYSA-N
SMILES:
CCC#CCCCCCCOC(C)(C)C
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.198g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.361g/mol
Monoisotopic Mass:
210.198g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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