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Cycloheptane

CAS No.:
291-64-5
Catalog Number:
AG002XC5
Molecular Formula:
C7H14
Molecular Weight:
98.1861
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Product Description
Catalog Number:
AG002XC5
Chemical Name:
Cycloheptane
CAS Number:
291-64-5
Molecular Formula:
C7H14
Molecular Weight:
98.1861
MDL Number:
MFCD00004147
IUPAC Name:
cycloheptane
InChI:
InChI=1S/C7H14/c1-2-4-6-7-5-3-1/h1-7H2
InChI Key:
DMEGYFMYUHOHGS-UHFFFAOYSA-N
SMILES:
C1CCCCCC1
EC Number:
206-030-2
UNII:
VTZ53P34JA
NSC Number:
5164
UN Number:
2241
Properties
Complexity:
19.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
98.11g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
98.189g/mol
Monoisotopic Mass:
98.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
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Properties