Home Halogens 3-(2,4-dichlorophenyl)prop-2-yn-1-ol

3-(2,4-dichlorophenyl)prop-2-yn-1-ol

CAS No.:
220707-97-1
Catalog Number:
AG01A6CT
Molecular Formula:
C9H6Cl2O
Molecular Weight:
201.0493
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Product Description
Catalog Number:
AG01A6CT
Chemical Name:
3-(2,4-dichlorophenyl)prop-2-yn-1-ol
CAS Number:
220707-97-1
Molecular Formula:
C9H6Cl2O
Molecular Weight:
201.0493
MDL Number:
MFCD06803817
IUPAC Name:
3-(2,4-dichlorophenyl)prop-2-yn-1-ol
InChI:
InChI=1S/C9H6Cl2O/c10-8-4-3-7(2-1-5-12)9(11)6-8/h3-4,6,12H,5H2
InChI Key:
JGWPOWBACBDELD-UHFFFAOYSA-N
SMILES:
OCC#Cc1ccc(cc1Cl)Cl
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.98g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
201.046g/mol
Monoisotopic Mass:
199.98g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties