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89058-48-0 | Furan, 2-(bromomethyl)-2-(2,4-dichlorophenyl)tetrahydro-4-propyl-
CAS No: 89058-48-0 Catalog No: AG0041KA MDL No:
Product Description
Catalog Number:
AG0041KA
Chemical Name:
Furan, 2-(bromomethyl)-2-(2,4-dichlorophenyl)tetrahydro-4-propyl-
CAS Number:
89058-48-0
Molecular Formula:
C14H17BrCl2O
Molecular Weight:
352.0942
IUPAC Name:
2-(bromomethyl)-2-(2,4-dichlorophenyl)-4-propyloxolane
InChI:
InChI=1S/C14H17BrCl2O/c1-2-3-10-7-14(9-15,18-8-10)12-5-4-11(16)6-13(12)17/h4-6,10H,2-3,7-9H2,1H3
InChI Key:
IBHFMIJAFCUPLN-UHFFFAOYSA-N
SMILES:
CCCC1COC(C1)(CBr)c1ccc(cc1Cl)Cl
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.984g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.093g/mol
Monoisotopic Mass:
349.984g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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