Home Carboxys methyl 1-methoxycycloheptane-1-carboxylate

methyl 1-methoxycycloheptane-1-carboxylate

CAS No.:
2137929-87-2
Catalog Number:
AG01EIRO
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
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Product Description
Catalog Number:
AG01EIRO
Chemical Name:
methyl 1-methoxycycloheptane-1-carboxylate
CAS Number:
2137929-87-2
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
MDL Number:
MFCD31457003
IUPAC Name:
methyl 1-methoxycycloheptane-1-carboxylate
InChI:
InChI=1S/C10H18O3/c1-12-9(11)10(13-2)7-5-3-4-6-8-10/h3-8H2,1-2H3
InChI Key:
PYMFFUQMXIONBZ-UHFFFAOYSA-N
SMILES:
COC1(CCCCCC1)C(=O)OC
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.126g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.251g/mol
Monoisotopic Mass:
186.126g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties