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N-(4-Chlorophenyl)-N-methylethylenediamine

HCID 88988
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Basic information

CAS
21647-84-7
Standard SMILES
CN(CCN)c1ccc(Cl)cc1
InChIKey
NEUAPOAFUOOCQR-UHFFFAOYSA-N
Molecular formula
C9H13ClN2
Average molar mass
184.66 g/mol
Monoisotopic mass
184.0767261

Names & identifiers

Preferred name
N-(4-Chlorophenyl)-N-methylethylenediamine
IUPAC
N'-(4-chlorophenyl)-N'-methylethane-1,2-diamine
English name
N-(4-chlorophenyl)-N-methylethylenediamine
Molecular formula
C9H13ClN2
Molecular weight
184.67

Names & synonyms

21647-84-7N-(4-Chlorophenyl)-N-methylethylenediamineN-(2-aminoethyl)-4-chloro-N-methylanilineN'-(4-chlorophenyl)-N'-methylethane-1,2-diamineN1-(4-Chlorophenyl)-N1-methylethane-1,2-diamineEINECS 244-495-3MFCD10031344SCHEMBL5188252DTXSID80176035AKOS006302660NS-01661NS00026931
Show more names
N-(p-Chlorophenyl)-N-methylethane-1,2-diamineN1-(4-Chlorophenyl)-N1-methyl-1,2-ethanediamine1,2-Ethanediamine, N1-(4-chlorophenyl)-N1-methyl-
N-(4-chloro-phenyl)-N-methyl-ethane-1,2-diamineN'-(4-chlorophenyl)-N'-methyl-ethane-1,2-diamineN-(4-chloro -phenyl)-N-methyl-ethane-1,2-diamineN~1~-(4-Chlorophenyl)-N~1~-methylethane-1,2-diamine

Database identifiers

CAS
21647-84-7
PubChem CID
88988
DTXSID
DTXSID80176035
EC Number
244-495-3
Nikkaji
J28.431I

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
29.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
122

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Related reactions

4 records
New reaction record
HRID 855237 reaction equation
HRID 855237As reactantuspto-grants-2007_08
HRID 855430 reaction equation
HRID 855430As reactantuspto-grants-2007_08
HRID 2137555 reaction equation
HRID 2137555As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2143553 reaction equation
HRID 2143553As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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