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88738-97-0

88738-97-0 | Cycloheptane, 1-bromo-2-(2-bromoethoxy)-

CAS No: 88738-97-0 Catalog No: AG004CSL MDL No:

Product Description

Catalog Number:
AG004CSL
Chemical Name:
Cycloheptane, 1-bromo-2-(2-bromoethoxy)-
CAS Number:
88738-97-0
Molecular Formula:
C9H16Br2O
Molecular Weight:
300.0307
IUPAC Name:
1-bromo-2-(2-bromoethoxy)cycloheptane
InChI:
InChI=1S/C9H16Br2O/c10-6-7-12-9-5-3-1-2-4-8(9)11/h8-9H,1-7H2
InChI Key:
AMEFGALKXGNESY-UHFFFAOYSA-N
SMILES:
BrCCOC1CCCCCC1Br

Properties

Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.955g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.034g/mol
Monoisotopic Mass:
297.957g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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