DMeOB

CAT: 0127-BUP08373-05Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP08373-05Size:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

40252-74-2

Synonyms

3,3'-Dimethoxybenzaldazine

Purity

=98%

Smiles

N(N=CC=1C=CC=C(OC)C1)=CC=2C=CC=C(OC)C2

Chemical Information

3-Methoxybenzaldehyde 2-((3-methoxyphenyl)methylene)hydrazone

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CAS Number	40252-74-2
PubChem CID	6891506
IUPAC Name	(E)-1-(3-methoxyphenyl)-N-[(E)-(3-methoxyphenyl)methylideneamino]methanimine
Molecular Formula	C16H16N2O2
Molecular Weight	268.31
XLogP	3.2
Topological Polar Surface Area	43.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	20
Formal Charge	0
Complexity	298

SMILES

COC1=CC=CC(=C1)/C=N/N=C/C2=CC(=CC=C2)OC

InChI

InChI=1S/C16H16N2O2/c1-19-15-7-3-5-13(9-15)11-17-18-12-14-6-4-8-16(10-14)20-2/h3-12H,1-2H3/b17-11+,18-12+

InChIKey

FBNPHFBYHYNMHC-JYFOCSDGSA-N

Chemical Structure

2D Structure

CAS: 40252-74-2

CID: 6891506

Formula: C16H16N2O2

MW: 268.31

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	268.31
XLogP3	3.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	268.121177757
Monoisotopic Mass	268.121177757
Topological Polar Surface Area	43.2 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	298
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
B6897-50	DMeOB
255167-01	DMeOB discontinued