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124345-16-0 | Heptane, 4-(dimethoxymethyl)-
CAS No: 124345-16-0 Catalog No: AG000LWQ MDL No:
Product Description
Catalog Number:
AG000LWQ
Chemical Name:
Heptane, 4-(dimethoxymethyl)-
CAS Number:
124345-16-0
Molecular Formula:
C10H22O2
Molecular Weight:
174.2805
IUPAC Name:
4-(dimethoxymethyl)heptane
InChI:
InChI=1S/C10H22O2/c1-5-7-9(8-6-2)10(11-3)12-4/h9-10H,5-8H2,1-4H3
InChI Key:
WJZQRVYBJZHRLM-UHFFFAOYSA-N
SMILES:
CCCC(C(OC)OC)CCC
Properties
Complexity:
83.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.162g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.284g/mol
Monoisotopic Mass:
174.162g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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