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138329-34-7 | Benzene, 2-methyl-1,3-bis(phenoxymethyl)-
CAS No: 138329-34-7 Catalog No: AG0018KQ MDL No:
Product Description
Catalog Number:
AG0018KQ
Chemical Name:
Benzene, 2-methyl-1,3-bis(phenoxymethyl)-
CAS Number:
138329-34-7
Molecular Formula:
C21H20O2
Molecular Weight:
304.3823
IUPAC Name:
2-methyl-1,3-bis(phenoxymethyl)benzene
InChI:
InChI=1S/C21H20O2/c1-17-18(15-22-20-11-4-2-5-12-20)9-8-10-19(17)16-23-21-13-6-3-7-14-21/h2-14H,15-16H2,1H3
InChI Key:
KRYSCKMAPHMDJF-UHFFFAOYSA-N
SMILES:
Cc1c(COc2ccccc2)cccc1COc1ccccc1
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.146g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.389g/mol
Monoisotopic Mass:
304.146g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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