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114377-54-7 | Cyclohexane, 1,1,3-trimethoxy-
CAS No: 114377-54-7 Catalog No: AG000B6T MDL No:
Product Description
Catalog Number:
AG000B6T
Chemical Name:
Cyclohexane, 1,1,3-trimethoxy-
CAS Number:
114377-54-7
Molecular Formula:
C9H18O3
Molecular Weight:
174.2374
IUPAC Name:
1,1,3-trimethoxycyclohexane
InChI:
InChI=1S/C9H18O3/c1-10-8-5-4-6-9(7-8,11-2)12-3/h8H,4-7H2,1-3H3
InChI Key:
VWGGBKLYHIBITQ-UHFFFAOYSA-N
SMILES:
COC1CCCC(C1)(OC)OC
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.126g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.24g/mol
Monoisotopic Mass:
174.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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