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87802-74-2 | Carbonic acid, 6-bromo-1-ethenylhexyl methyl ester
CAS No: 87802-74-2 Catalog No: AG004HF5 MDL No:
Product Description
Catalog Number:
AG004HF5
Chemical Name:
Carbonic acid, 6-bromo-1-ethenylhexyl methyl ester
CAS Number:
87802-74-2
Molecular Formula:
C10H17BrO3
Molecular Weight:
265.1442
IUPAC Name:
8-bromooct-1-en-3-yl methyl carbonate
InChI:
InChI=1S/C10H17BrO3/c1-3-9(14-10(12)13-2)7-5-4-6-8-11/h3,9H,1,4-8H2,2H3
InChI Key:
ORSVBCHTGKLORY-UHFFFAOYSA-N
SMILES:
COC(=O)OC(C=C)CCCCCBr
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.036g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.147g/mol
Monoisotopic Mass:
264.036g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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