(2,4-Dimethylbenzylidene)-p-tolylamine
PubChem CID
614016
Structure
Molecular Formula
Synonyms
- (2,4-Dimethylbenzylidene)-p-tolylamine
- OXXCWSWSHDCZFN-GZTJUZNOSA-N
- N-[(E)-(2,4-Dimethylphenyl)methylidene]-4-methylaniline #
Molecular Weight
223.31 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Dates
- Create:2005-03-27
- Modify:2024-12-07
Chemical Structure Depiction
1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine
Computed by Lexichem TK 2.7.0 (PubChem release 2021.10.14)
InChI=1S/C16H17N/c1-12-5-8-16(9-6-12)17-11-15-7-4-13(2)10-14(15)3/h4-11H,1-3H3
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
OXXCWSWSHDCZFN-UHFFFAOYSA-N
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
CC1=CC=C(C=C1)N=CC2=C(C=C(C=C2)C)C
Computed by OEChem 2.3.0 (PubChem release 2021.10.14)
C16H17N
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
223.31 g/mol
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
XLogP3-AA
Property Value
4.3
Reference
Computed by XLogP3 3.0 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Donor Count
Property Value
0
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Acceptor Count
Property Value
1
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Rotatable Bond Count
Property Value
2
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Exact Mass
Property Value
223.136099547 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Monoisotopic Mass
Property Value
223.136099547 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Topological Polar Surface Area
Property Value
12.4Ų
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Heavy Atom Count
Property Value
17
Reference
Computed by PubChem
Property Name
Formal Charge
Property Value
0
Reference
Computed by PubChem
Property Name
Complexity
Property Value
250
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Isotope Atom Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Covalently-Bonded Unit Count
Property Value
1
Reference
Computed by PubChem
Property Name
Compound Is Canonicalized
Property Value
Yes
Reference
Computed by PubChem (release 2021.10.14)
NIST Number
190216
Library
Main library
Total Peaks
141
m/z Top Peak
223
m/z 2nd Highest
206
m/z 3rd Highest
222
Thumbnail
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Similar Compounds (2D)
Similar Conformers (3D)
Same Count
- Japan Chemical Substance Dictionary (Nikkaji)
- NIST Mass Spectrometry Data CenterLICENSEData covered by the Standard Reference Data Act of 1968 as amended.https://www.nist.gov/srd/public-law(2,4-Dimethylbenzylidene)-p-tolylaminehttp://www.nist.gov/srd/nist1a.cfm
- PubChem
CONTENTS