Basic information
- CAS
136-44-7- Standard SMILES
Nc1ccc(C(=O)OCC(O)CO)cc1- InChIKey
WHQOKFZWSDOTQP-UHFFFAOYSA-N- Molecular formula
- C10H13NO4
- Average molar mass
- 211.21 g/mol
- Monoisotopic mass
- 211.0844579
Overview
used as sunscreening agent
Names & identifiers
- Preferred name
- 2,3-Dihydroxypropyl 4-aminobenzoate
- IUPAC
- 2,3-dihydroxypropyl 4-aminobenzoate
- English name
- GLYCERYL P-AMINOBENZOATE
- Molecular formula
- C10H13NO4
- Molecular weight
- 211.21
Names & synonyms
2,3-dihydroxypropyl 4-aminobenzoateglycerol p-aminobenzoateRefChem:410748Lisadimate136-44-7Glyceryl pabaGlyceryl p-aminobenzoateLisadimatoLisadimate (>85%)Glycerol 1-(p-aminobenzoate)Monoglyceryl p-aminobenzoateDTXSID8042002
Show more names
Ai3-25249escalol106Brn 2727968glycerylpabaGLYCEROLPABAglycerylpara-aminobenzoateGLYCEROLPARA-AMINOBENZOATE
(+/-)-Glycerol 1-(p-aminobenzoate)A886B5N5IMEscalol 106LisadimatumLisadimate [USAN:INN]Lisadimatum [INN-Latin]Glyceryl para-aminobenzoateLisadimato [INN-Spanish]
Database identifiers
- CAS
136-44-7- PubChem CID
- 8692
- DTXSID
DTXSID8042002- ChEMBL
CHEMBL2106668- UNII
- A886B5N5IM
- EC Number
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 92.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 202
Physicochemical properties
- Melting point
- 116 · 116-117 °C
- Boiling point
- 350.89 °C · 350.89°C (rough estimate)
- Density
- 1.2545 · 1.2545 (rough estimate)
- refractive index
- 1.515 · 1.5150 (estimate)
- storage temp.
- -20 °C · -20°C Freezer, Under inert atmosphere
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 13.15 · 13.15±0.20(Predicted)
- color
- Off-White to Pale Beige
- Cosmetics Ingredients Functions
- UV ABSORBER
- LogP
- -0.28 · -0.280 (est)
- FDA UNII
- 886 B5N5IM · A886B5N5IM
- EPA Substance Registry System
- 1 · Glycerol 1-(p-aminobenzoate) (136-44-7)
- TSCA
- TSCA listed
Safety & regulation
Hazard information
Regulatory InformationChemical: 1,2,3-Propanetriol, 1-(4-aminobenzoate)
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,2,3-Propanetriol, 1-(4-aminobenzoate): ACTIVE
Applications
UsesLisadimate is used as a sunscreen agent.
UsesIn cosmetic sunscreen Preparations (up to 1%).
Suppliers6 total
北京华美互利生物化工010-56205725 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
南京佰瑞利康生物科技有限公司18168036974 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
1 records
Compound notes
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