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101970-63-2 | 1,3-Benzodioxole, 5-[1-(2-methoxyethoxy)ethyl]-
CAS No: 101970-63-2 Catalog No: AG00064T MDL No:
Product Description
Catalog Number:
AG00064T
Chemical Name:
1,3-Benzodioxole, 5-[1-(2-methoxyethoxy)ethyl]-
CAS Number:
101970-63-2
Molecular Formula:
C12H16O4
Molecular Weight:
224.2530
IUPAC Name:
5-[1-(2-methoxyethoxy)ethyl]-1,3-benzodioxole
InChI:
InChI=1S/C12H16O4/c1-9(14-6-5-13-2)10-3-4-11-12(7-10)16-8-15-11/h3-4,7,9H,5-6,8H2,1-2H3
InChI Key:
STZRTUNMLCEUSW-UHFFFAOYSA-N
SMILES:
COCCOC(c1ccc2c(c1)OCO2)C
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.256g/mol
Monoisotopic Mass:
224.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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