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29022-31-9 | 4-Nonyne, 3,3-dimethyl-
CAS No: 29022-31-9 Catalog No: AG002V8S MDL No:
Product Description
Catalog Number:
AG002V8S
Chemical Name:
4-Nonyne, 3,3-dimethyl-
CAS Number:
29022-31-9
Molecular Formula:
C11H20
Molecular Weight:
152.2765
IUPAC Name:
3,3-dimethylnon-4-yne
InChI:
InChI=1S/C11H20/c1-5-7-8-9-10-11(3,4)6-2/h5-8H2,1-4H3
InChI Key:
DEPWYUIUNKUYSW-UHFFFAOYSA-N
SMILES:
CCCCC#CC(CC)(C)C
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.157g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.281g/mol
Monoisotopic Mass:
152.157g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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