4-Chloro-5-methylbenzene-1,2-diamine

HCID 2801468CAS 63155-04-4
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1cc(N)c(N)cc1Cl
InChIKey
HOFKXNBVTNUDSH-UHFFFAOYSA-N
Molecular formula
C7H9ClN2
Average molar mass
156.61 g/mol
Monoisotopic mass
156.045426

Names & identifiers

Preferred name
4-Chloro-5-methylbenzene-1,2-diamine
IUPAC
4-chloro-5-methylbenzene-1,2-diamine
English name
4-Chloro-5-methylbenzene-1,2-diamine
Molecular formula
C7H9ClN2
Molecular weight
156.61

Names & synonyms

4-chloro-5-methylbenzene-1,2-diamineDTXSID20384253RefChem:1070500DTXCID9033527763155-04-44-Chloro-5-methyl-O-phenylenediamineMFCD002214714mrh4-Chloro-5-methyl-benzene-1,2-diamineSCHEMBL404439CHEMBL3237625BBL009380
Show more names
TL 007702-Chloro-4,5-diaminotoluene1,2-Diamino-4-chloro-5-methylbenzene4-CHLORO-1,2-DIAMINO-5-METHYLBENZENE2-Amino-4-chloro-5-methylphenylamine4-Chloro-5-Methyl-1,2-benzenediaMine4-Chloro-5-methyl-1,2-phenylenediamine
BDBM50008915PS-4709BP-10339SY0814211,2-Benzenediamine, 4-chloro-5-methyl-Q274528882CQ(2-amino-4-chloro-5-methylphenyl)amine

Database identifiers

CAS
63155-04-4
PubChem CID
2801468
DTXSID
DTXSID20384253
ChEMBL
CHEMBL3237625
Nikkaji
J90.230F

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
52 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
10

Physicochemical properties

Melting point
137 °C · 137 °C
Boiling point
307 · 307.0±37.0 °C(Predicted)
Density
1.281 · 1.281±0.06 g/cm3(Predicted)
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
solubility
Dichloroform, Ethyl Acetate, Methanol
pka
3.65 · 3.65±0.10(Predicted)

Safety & regulation

Safety data

wgk
WGK 3
hs_code
2921511990
risk_code
20/21/22-36/37/38-36
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi

Chemistry & industry

Applications

Uses4-Chloro-5-methyl-O-phenylenediamine (cas# 63155-04-4) is a compound useful in organic synthesis.

Upstream & downstream products

Suppliers50 total

上海康恩博医药科技有限公司17510465506 · [email protected]
上海策嵘生物科技有限公司[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]

Related reactions

16 records
New reaction record

Linked notes

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