CAS 2049-73-2 | Benzene, 1,3-diethoxy- | CAS Number 2049-73-2

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2049-73-2 | Benzene, 1,3-diethoxy-

CAS No: 2049-73-2 Catalog No: AG0029R1 MDL No:MFCD00015145

Product Description

Catalog Number:

AG0029R1

Chemical Name:

Benzene, 1,3-diethoxy-

CAS Number:

2049-73-2

Molecular Formula:

C10H14O2

Molecular Weight:

166.2170

MDL Number:

MFCD00015145

IUPAC Name:

1,3-diethoxybenzene

InChI:

InChI=1S/C10H14O2/c1-3-11-9-6-5-7-10(8-9)12-4-2/h5-8H,3-4H2,1-2H3

InChI Key:

MKGFYMKFBCWNCP-UHFFFAOYSA-N

SMILES:

CCOc1cccc(c1)OCC

EC Number:

218-071-3

NSC Number:

4888

Properties

Complexity:

102

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

166.099g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

166.22g/mol

Monoisotopic Mass:

166.099g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

18.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9

Literature

Title	Journal
Screening of dialkoxybenzenes and disubstituted cyclopentene derivatives against the cabbage looper, Trichoplusia ni, for the discovery of new feeding and oviposition deterrents.	Journal of agricultural and food chemistry 20071212
Conformational interconversions in [2]catenanes containing a wide rigid bis(p-benzyl)methyl spacer.	The Journal of organic chemistry 20070817