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188947-39-9 | Benzene, 1,4-bis(chloromethyl)-2,5-bis[(2S)-2-methylbutoxy]-
CAS No: 188947-39-9 Catalog No: AG002HL8 MDL No:
Product Description
Catalog Number:
AG002HL8
Chemical Name:
Benzene, 1,4-bis(chloromethyl)-2,5-bis[(2S)-2-methylbutoxy]-
CAS Number:
188947-39-9
Molecular Formula:
C18H28Cl2O2
Molecular Weight:
347.3197
IUPAC Name:
1,4-bis(chloromethyl)-2,5-bis[(2S)-2-methylbutoxy]benzene
InChI:
InChI=1S/C18H28Cl2O2/c1-5-13(3)11-21-17-7-16(10-20)18(8-15(17)9-19)22-12-14(4)6-2/h7-8,13-14H,5-6,9-12H2,1-4H3/t13-,14-/m0/s1
InChI Key:
AIRVXTVDHHXYFC-KBPBESRZSA-N
SMILES:
ClCc1cc(OC[C@H](CC)C)c(cc1OC[C@H](CC)C)CCl
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
346.147g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
347.32g/mol
Monoisotopic Mass:
346.147g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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