Home Other Building Blocks 2-(2,5-dimethoxyphenyl)oxirane

2-(2,5-dimethoxyphenyl)oxirane

CAS No.:
83436-65-1
Catalog Number:
AG019UYN
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
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Product Description
Catalog Number:
AG019UYN
Chemical Name:
2-(2,5-dimethoxyphenyl)oxirane
CAS Number:
83436-65-1
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
MDL Number:
MFCD09733178
IUPAC Name:
2-(2,5-dimethoxyphenyl)oxirane
InChI:
InChI=1S/C10H12O3/c1-11-7-3-4-9(12-2)8(5-7)10-6-13-10/h3-5,10H,6H2,1-2H3
InChI Key:
LIDCSATVCNIHNS-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C1CO1)OC
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
31A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties