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NSC21115

CAS No.:
4534-76-3
Catalog Number:
AG00DJ0Z
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
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Product Description
Catalog Number:
AG00DJ0Z
Chemical Name:
NSC21115
CAS Number:
4534-76-3
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
MDL Number:
MFCD18917264
IUPAC Name:
3-ethylcyclohexan-1-ol
InChI:
InChI=1S/C8H16O/c1-2-7-4-3-5-8(9)6-7/h7-9H,2-6H2,1H3
InChI Key:
UNIOXDKEUNVBAC-UHFFFAOYSA-N
SMILES:
CCC1CCCC(C1)O
NSC Number:
21115
Properties
Complexity:
80.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.12g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
128.215g/mol
Monoisotopic Mass:
128.12g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties