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161529-89-1 | Carbonic acid, methoxymethyl 1-methylheptyl ester
CAS No: 161529-89-1 Catalog No: AG001VNR MDL No:
Product Description
Catalog Number:
AG001VNR
Chemical Name:
Carbonic acid, methoxymethyl 1-methylheptyl ester
CAS Number:
161529-89-1
Molecular Formula:
C11H22O4
Molecular Weight:
218.2900
IUPAC Name:
methoxymethyl octan-2-yl carbonate
InChI:
InChI=1S/C11H22O4/c1-4-5-6-7-8-10(2)15-11(12)14-9-13-3/h10H,4-9H2,1-3H3
InChI Key:
HGOOWUJKHPIGLP-UHFFFAOYSA-N
SMILES:
CCCCCCC(OC(=O)OCOC)C
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.152g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.293g/mol
Monoisotopic Mass:
218.152g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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