4-Methoxy-o-phenylenediamine

HCID 153404
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Basic information

CAS
102-51-2
Standard SMILES
COc1ccc(N)c(N)c1
InChIKey
AGAHETWGCFCMDK-UHFFFAOYSA-N
Molecular formula
C7H10N2O
Average molar mass
138.17 g/mol
Monoisotopic mass
138.07931294

Names & identifiers

Preferred name
4-Methoxy-o-phenylenediamine
IUPAC
4-methoxybenzene-1,2-diamine
English name
4-Methoxy-o-phenylenediamine
Molecular formula
C7H10N2O
Molecular weight
138.17

Names & synonyms

4-Methoxy-o-phenylenediamine4-methoxy-1,2-phenylenediamineRefChem:524698600-319-03,4-Diaminoanisole102-51-24-methoxybenzene-1,2-diamine1,2-Benzenediamine, 4-methoxy-4-Methoxy-1,2-benzenediamine1,2-Diamino-4-methoxybenzene2-amino-4-methoxyphenylamineMFCD00047837
Show more names
3,4-DiaminoanisoL3,4-DIAMINO ANISOLE3,4-Diaminoanisidine4-Methoxy-2-aMinoaniline2-DiaMino-4-Methoxybenzene4-methoxy-2-benzenediamine4-methoxy-o-phenylenediaminp-Methoxy-o-phenylenediaMine
o-Phenylenediamine, 4-methoxy-4-Methoxy-1,2-diaminobenzene2-Amino-4-methoxy aniline1,2-diamino-4-methoxy-benzeneSTR02678AKOS000103845CS-W001175SY032808

Database identifiers

CAS
102-51-2
PubChem CID
153404
DTXSID
DTXSID00144514
UNII
57B24QB262
EC Number
600-319-0
Nikkaji
J141.525E

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
61.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
10

Physicochemical properties

Melting point
46 · 46-48°C
Boiling point
253.57 °C · 253.57°C (rough estimate)
Density
1.1315 · 1.1315 (rough estimate)
refractive index
1.52 · 1.5200 (estimate)
RTECS
2690000 · ST2690000
storage temp.
2 · Keep in dark place,Inert atmosphere,2-8°C

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H301+H311+H331 (11.1%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P260, P261, P262, P264, P264+P265, P270, P271, P280, P284, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P320, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 9 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (66.7%)

Safety data

ridadr
2811
hs_code
2922190090
risk_code
23/24/25-36/37/38
Signal word
Danger
Symbol(GHS)
GHS07
hazard_code
Xi

Chemistry & industry

Applications · 1 item

Uses4-Methoxy-o-phenylenediamine is widely used as an intermediate in organic synthesis and pharmaceuticals. It is an important precursor for the synthesis of other heterocyclic compounds. It is used in the determination of glyoxal, methylglyoxal, and diacetyl in urine using 4-methoxy-o-phenylenediamine as a derivatizing reagent by High-performance liquid chromatography (HPLC).

Upstream & downstream products

Suppliers100 total

常州帝通化工有限公司+86-0519-88298848 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
湖北博杰生物科技有限公司0713-2060728 15629612610
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]

Related reactions

70 records
New reaction record

Compound notes

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