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139892-49-2 | 1,3-Dioxolane, 4-(chloromethyl)-2,2-diethyl-, (R)- (9CI)
CAS No: 139892-49-2 Catalog No: AG001BS7 MDL No:
Product Description
Catalog Number:
AG001BS7
Chemical Name:
1,3-Dioxolane, 4-(chloromethyl)-2,2-diethyl-, (R)- (9CI)
CAS Number:
139892-49-2
Molecular Formula:
C8H15ClO2
Molecular Weight:
178.6565
IUPAC Name:
(4R)-4-(chloromethyl)-2,2-diethyl-1,3-dioxolane
InChI:
InChI=1S/C8H15ClO2/c1-3-8(4-2)10-6-7(5-9)11-8/h7H,3-6H2,1-2H3/t7-/m0/s1
InChI Key:
XNNKOCCDSFHFKU-ZETCQYMHSA-N
SMILES:
ClC[C@H]1COC(O1)(CC)CC
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
178.076g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.656g/mol
Monoisotopic Mass:
178.076g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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