2-([(2,4-Dimethoxyphenyl)methyl]amino)acetonitrile

HCID 178788730CAS 94459-09-3
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Basic information

Standard SMILES
COc1ccc(CNCC#N)c(OC)c1
InChIKey
DOVKINZSEUSJDC-UHFFFAOYSA-N
Molecular formula
C11H14N2O2
Average molar mass
206.24 g/mol

Names & identifiers

Preferred name
2-([(2,4-Dimethoxyphenyl)methyl]amino)acetonitrile
IUPAC
2-[(2,4-dimethoxyphenyl)methylamino]acetonitrile
English name
2-{[(2,4-Dimethoxyphenyl)methyl]amino}-acetonitrile hydrochloride
Molecular formula
C11H14N2O2
Molecular weight
206.24

Names & synonyms

2-([(2,4-Dimethoxyphenyl)methyl]amino)acetonitrileNSC617216SCHEMBL10870273AKOS012667865AT54534NSC-6172162-((2,4-DIMETHOXYBENZYL)AMINO)ACETONITRILEacetonitrileAcetonitrile, 2-[[(2,4-dimethoxyphenyl)methyl]amino]-2-{[(2,4-Dimethoxyphenyl)methyl]amino}-acetonitrile hydrochloride

Database identifiers

CAS
94459-09-3

Properties

Computed structural properties

XLogP
1
Topological polar surface area
54.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
15

Physicochemical properties

HS Code
2926907090 · 2926907090

Safety & regulation

Safety data

hs_code
2926907090

Chemistry & industry

Suppliers1 total

北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]

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