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20210-14-4 | 1,3-Dioxolane, 2-(4-bromobutyl)-2-methyl-
CAS No: 20210-14-4 Catalog No: AG00281V MDL No:
Product Description
Catalog Number:
AG00281V
Chemical Name:
1,3-Dioxolane, 2-(4-bromobutyl)-2-methyl-
CAS Number:
20210-14-4
Molecular Formula:
C8H15BrO2
Molecular Weight:
223.1075
IUPAC Name:
2-(4-bromobutyl)-2-methyl-1,3-dioxolane
InChI:
InChI=1S/C8H15BrO2/c1-8(4-2-3-5-9)10-6-7-11-8/h2-7H2,1H3
InChI Key:
LILWCYXXHPIZSQ-UHFFFAOYSA-N
SMILES:
BrCCCCC1(C)OCCO1
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.026g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.11g/mol
Monoisotopic Mass:
222.026g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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