Basic information
- Standard SMILES
COC(=O)N1C(=O)C=CC1=O- InChIKey
LLAZQXZGAVBLRX-UHFFFAOYSA-N- Molecular formula
- C6H5NO4
- Average molar mass
- 155.11 g/mol
- Monoisotopic mass
- 155.02185764
Names & identifiers
- Preferred name
- N-(Methoxycarbonyl)maleimide
- IUPAC
- methyl 2,5-dioxopyrrole-1-carboxylate
- English name
- N-Methoxycarbonylmaleimide
- Molecular formula
- C6H5NO4
- Molecular weight
- 155.11
Names & synonyms
55750-48-6N-(Methoxycarbonyl)maleimideMethyl 2,5-dihydro-2,5-dioxo-1H-pyrrole-1-carboxylateDTXSID70204311RefChem:1091440DTXCID70126802259-792-3N-MethoxycarbonylmaleimideMethyl 2,5-dioxo-2,5-dihydro-1H-pyrrole-1-carboxylateN-(Methoxycarbonyl) Maleimidemethyl 2,5-dioxopyrrole-1-carboxylateMFCD00042755
Show more names
106271N-Methoxycarbonylmaleimide>N-methoxycarbonylmaleimide 98%N-methyoxy carbonyl maleimide 97%
EINECS 259-792-3n-methoxycarbonylmaleinimide1H-Pyrrole-1-carboxylic acid, 2,5-dihydro-2,5-dioxo-, methyl estermethyl 2,5-dioxo-2H-pyrrole-1(5H)-carboxylateM2333Z1255486023Methyl 2,5-dioxo-2,5-dihydro-1H-pyrrole-1-carboxylate #N-(Carbomethoxy)maleimide
Database identifiers
- CAS
55750-48-6- PubChem CID
- 580610
- DTXSID
DTXSID70204311- EC Number
- 259-792-3
- Nikkaji
- J296.487B
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 63.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 237
Physicochemical properties
- Melting point
- 63 · 63-65 °C
- Boiling point
- 242.5 · 242.5±23.0 °C(Predicted)
- Density
- 1.496 · 1.496±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Inert atmosphere,2-8°C
- solubility
- DMSO (Slightly), Ethyl Acetate (Slightly), Chloroform
- form
- Solid
- pka
- -3.17 · -3.17±0.20(Predicted)
- color
- Off-White to Pink
- BRN
- 1450638 · 1450638
- InChI
- InChI=1S/C6H5NO4/c1-11-6(10)7-4(8)2-3-5(7)9/h2-3H,1H3
- InChIKey
- LLAZQXZGAVBLRX-UHFFFAOYSA-N
- SMILES
- N1(C(OC)=O)C(=O)C=CC1=O
- UNSPSC Code
- 12352100 · 12352100
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 271 · P271-P261-P280
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
- F
- 10 · 10
- HS Code
- 29251900 · 29251900
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Irrit. 2
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- F
- 10
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- hs_code
- 29251900
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2
- Precautionary statements
- P271-P261-P280
Chemistry & industry
Applications
UsesN-(Methoxycarbonyl) Maleimide (cas# 55750-48-6) is a compound useful in organic synthesis.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers50 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
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Related reactions
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