Home Halogens 2-chloro-1-ethynyl-4-methoxybenzene

2-chloro-1-ethynyl-4-methoxybenzene

CAS No.:
153440-68-7
Catalog Number:
AG01BV0Z
Molecular Formula:
C9H7ClO
Molecular Weight:
166.6043
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BV0Z
Chemical Name:
2-chloro-1-ethynyl-4-methoxybenzene
CAS Number:
153440-68-7
Molecular Formula:
C9H7ClO
Molecular Weight:
166.6043
MDL Number:
MFCD27945296
IUPAC Name:
2-chloro-1-ethynyl-4-methoxybenzene
InChI:
InChI=1S/C9H7ClO/c1-3-7-4-5-8(11-2)6-9(7)10/h1,4-6H,2H3
InChI Key:
LSTDMADOYKDOFL-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)Cl)C#C
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.019g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.604g/mol
Monoisotopic Mass:
166.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties