N-Benzyl-o-toluidine

HCID 79402
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Basic information

CAS
5405-13-0
Standard SMILES
Cc1ccccc1NCc1ccccc1
InChIKey
QFRIIGBAHKSVIU-UHFFFAOYSA-N
Molecular formula
C14H15N
Average molar mass
197.27 g/mol
Monoisotopic mass
197.12044948

Names & identifiers

Preferred name
N-Benzyl-o-toluidine
IUPAC
N-benzyl-2-methylaniline
English name
N-benzyl-o-toluidine
Molecular formula
C14H15N
Molecular weight
197.28

Names & synonyms

N-benzyl-2-methylanilineN-Benzyl-o-toluidine5405-13-0o-Toluidine, N-benzyl-Benzenemethanamine, N-(2-methylphenyl)-N-(2-tolyl)benzylamineN-(2-Methylphenyl)benzenemethanamineN82T6X6QUJN-(o-Methylphenyl)benzylamineN-benzyl-N-(2-methylphenyl)amineNSC-8083N-o-Tolylbenzylamine
Show more names
benzyl-(2-methylphenyl)amineN-(2-Methylphenyl)benzylamine2-methyl-N-(phenylmethyl)aniline
N-(o-tolyl)benzylamineTolyl-benzyl-aminNSC8083EINECS 226-454-1Benzenemethanamine,N-(2-methylphenyl)-N-benzyl-2-methyl-anilineUNII-N82T6X6QUJN-Benzyl-2-methylbenzenamine

Database identifiers

CAS
5405-13-0
PubChem CID
79402
DTXSID
DTXSID50202375
UNII
N82T6X6QUJ
EC Number
226-454-1
Nikkaji
J217.965B

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
12 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
15

Experimental & physicochemical properties

SpringerMaterials PropertiesOptical coefficient

Physicochemical properties

Melting point
60 °C · 60°C
Boiling point
324.39 °C · 324.39°C (rough estimate)
Density
1.0142 · 1.0142
refractive index
1.5861 · 1.5861
pka
3.77 · 3.77±0.10(Predicted)
FDA UNII
82 T6X6QUJ · N82T6X6QUJ

Chemistry & industry

Upstream & downstream products

Suppliers9 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]

Related reactions

9 records
New reaction record

Compound notes

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