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1263376-32-4 | 3-Methylcyclohexanecarboxylic anhydride
CAS No: 1263376-32-4 Catalog No: AG01FC9N MDL No:MFCD18379761
Product Description
Catalog Number:
AG01FC9N
Chemical Name:
3-Methylcyclohexanecarboxylic anhydride
CAS Number:
1263376-32-4
Molecular Formula:
C16H26O3
Molecular Weight:
266.3758
MDL Number:
MFCD18379761
IUPAC Name:
(3-methylcyclohexanecarbonyl) 3-methylcyclohexane-1-carboxylate
InChI:
InChI=1S/C16H26O3/c1-11-5-3-7-13(9-11)15(17)19-16(18)14-8-4-6-12(2)10-14/h11-14H,3-10H2,1-2H3
InChI Key:
KYKCBFSCRHKEOM-UHFFFAOYSA-N
SMILES:
CC1CCCC(C1)C(=O)OC(=O)C1CCCC(C1)C
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.188g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.381g/mol
Monoisotopic Mass:
266.188g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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