Home Carboxys Methyl 1,4-benzodioxan-2-carboxylate

Methyl 1,4-benzodioxan-2-carboxylate

CAS No.:
3663-79-4
Catalog Number:
AG00355A
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
1 week
United States
$107
- +
Product Description
Catalog Number:
AG00355A
Chemical Name:
Methyl 1,4-benzodioxan-2-carboxylate
CAS Number:
3663-79-4
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
MDL Number:
MFCD00297092
IUPAC Name:
methyl 2,3-dihydro-1,4-benzodioxine-3-carboxylate
InChI:
InChI=1S/C10H10O4/c1-12-10(11)9-6-13-7-4-2-3-5-8(7)14-9/h2-5,9H,6H2,1H3
InChI Key:
SNLAAGHHNZECPE-UHFFFAOYSA-N
SMILES:
COC(=O)C1COc2c(O1)cccc2
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.186g/mol
Monoisotopic Mass:
194.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties