Home Halogens 3-(chloromethyl)hept-1-yn-3-ol

3-(chloromethyl)hept-1-yn-3-ol

CAS No.:
128650-03-3
Catalog Number:
AG01C0E6
Molecular Formula:
C8H13ClO
Molecular Weight:
160.6412
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Product Description
Catalog Number:
AG01C0E6
Chemical Name:
3-(chloromethyl)hept-1-yn-3-ol
CAS Number:
128650-03-3
Molecular Formula:
C8H13ClO
Molecular Weight:
160.6412
MDL Number:
MFCD19235198
IUPAC Name:
3-(chloromethyl)hept-1-yn-3-ol
InChI:
InChI=1S/C8H13ClO/c1-3-5-6-8(10,4-2)7-9/h2,10H,3,5-7H2,1H3
InChI Key:
XEALFIPMTNLHDK-UHFFFAOYSA-N
SMILES:
CCCCC(C#C)(CCl)O
Properties
Complexity:
135  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.065g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
160.641g/mol
Monoisotopic Mass:
160.065g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties