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6553-80-6 | CYCLOHEXANECARBOXYLIC ACID ISOPROPYL ESTER
CAS No: 6553-80-6 Catalog No: AG003P4M MDL No:MFCD00058949
Product Description
Catalog Number:
AG003P4M
Chemical Name:
CYCLOHEXANECARBOXYLIC ACID ISOPROPYL ESTER
CAS Number:
6553-80-6
MDL Number:
MFCD00058949
IUPAC Name:
propan-2-yl cyclohexanecarboxylate
InChI:
InChI=1S/C10H18O2/c1-8(2)12-10(11)9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3
InChI Key:
PMQZNGSMBAGPRU-UHFFFAOYSA-N
EC Number:
229-474-9
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.131g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.252g/mol
Monoisotopic Mass:
170.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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