2-Hepten-4-yne, 1-chloro-6,6-dimethyl-


Chemical Name: 2-Hepten-4-yne, 1-chloro-6,6-dimethyl-
CAS Number: 126764-17-8
Product Number: AG000T82(AGN-PC-0084TH)
Synonyms:
MDL No:
Molecular Formula: C9H13Cl
Molecular Weight: 156.6525

Identification/Properties


Properties
BP:
207.5°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
1.4850
Computed Properties
Molecular Weight:
156.653g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
0
Rotatable Bond Count:
2
Exact Mass:
156.071g/mol
Monoisotopic Mass:
156.071g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
170
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P302+P352-P305+P351+P338-P321-P405-P501
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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