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4630-80-2

4630-80-2 | Methyl Cyclopentanecarboxylate

CAS No: 4630-80-2 Catalog No: AG0038QF MDL No:MFCD00019290

Product Description

Catalog Number:
AG0038QF
Chemical Name:
Methyl Cyclopentanecarboxylate
CAS Number:
4630-80-2
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
MDL Number:
MFCD00019290
IUPAC Name:
methyl cyclopentanecarboxylate
InChI:
InChI=1S/C7H12O2/c1-9-7(8)6-4-2-3-5-6/h6H,2-5H2,1H3
InChI Key:
IIHIJFJSXPDTNO-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCCC1
EC Number:
225-049-7
NSC Number:
87553

Properties

Complexity:
104  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.084g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.171g/mol
Monoisotopic Mass:
128.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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