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88349-59-1 | Carbonic acid, 1-bromocyclohexyl 2-chloroethyl ester
CAS No: 88349-59-1 Catalog No: AG0045ZA MDL No:
Product Description
Catalog Number:
AG0045ZA
Chemical Name:
Carbonic acid, 1-bromocyclohexyl 2-chloroethyl ester
CAS Number:
88349-59-1
Molecular Formula:
C9H14BrClO3
Molecular Weight:
285.5627
IUPAC Name:
(1-bromocyclohexyl) 2-chloroethyl carbonate
InChI:
InChI=1S/C9H14BrClO3/c10-9(4-2-1-3-5-9)14-8(12)13-7-6-11/h1-7H2
InChI Key:
MYSUHNCJYKHKAC-UHFFFAOYSA-N
SMILES:
ClCCOC(=O)OC1(Br)CCCCC1
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.981g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.562g/mol
Monoisotopic Mass:
283.981g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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