Basic information
- CAS
1334-87-8- Standard SMILES
COC(=O)Cc1cccc2ccccc12- InChIKey
YGGXZTQSGNFKPJ-UHFFFAOYSA-N- Molecular formula
- C13H12O2
- Average molar mass
- 200.23 g/mol
- Monoisotopic mass
- 200.08372962
Names & identifiers
- Preferred name
- Methyl 1-naphthylacetate
- IUPAC
- methyl 2-naphthalen-1-ylacetate
- English name
- Methyl naphthalene-1-acetate
- Molecular formula
- C13H12O2
- Molecular weight
- 200.23
Names & synonyms
Methyl 1-naphthaleneacetate2876-78-0Methyl 1-naphthylacetateHormonitKartofin1-NAPHTHALENEACETIC ACID, METHYL ESTERM 1 (Growth regulator)Latka M-1Methyl alpha-naphthylacetateMethyl naphthaleneacetic acidLatka M-1 [Czech]Methyl 1-naphthaleneacetic acid
Show more names
1-naphthaleneaceticlatkam-1AKOS AU36-M589ASISCHEM D13377m1(growthregulator)Methyl naphthacetateMETHYL A-NAPHTHYLACETATE
NSC 122030methyl 1-naphthalenylacetateNaphthaleneacetic acid methyl esterMethyl .alpha.-naphthylacetateDTXSID2042143B2TU4BI7PT.alpha.-Naphthaleneacetic acid methyl esterMethylester kyseliny 1-naftyloctove
Database identifiers
- CAS
1334-87-8、2876-78-0- PubChem CID
- 17891
- DTXSID
DTXSID2042143- ChEMBL
CHEMBL3182503- UNII
- B2TU4BI7PT
- EC Number
- 220-720-0
- Nikkaji
- J7.925A
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 225
Experimental & physicochemical properties
SpringerMaterials PropertiesSurface tension
Physicochemical properties
- Melting point
- 143 · 143-144 °C
- Boiling point
- 160 · 160-162 °C5 mm Hg(lit.)
- Density
- 1.142 g/mL · 1.142 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.597(lit.)
- Flash point
- 230 °F · >230 °F
- storage temp.
- Sealed in dry,Room Temperature
- color
- Colorless to Light yellow
- Water Solubility
- Sparingly soluble in water.
- BRN
- 1956293 · 1956293
- CAS DataBase Reference
- 2876 · 2876-78-0(CAS DataBase Reference)
- FDA UNII
- 2 TU4BI7PT · B2TU4BI7PT
- NIST Chemistry Reference
- 1 · 1-Naphthaleneacetic acid, methyl ester(2876-78-0)
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- rtecs
- QJ1225000
- hs_code
- 2916399090
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 36
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P501
Chemistry & industry
Applications
UsesMethyl 1-naphthylacetate, is also used as an important raw material and intermediate used in organic Synthesis, pharmaceuticals, agrochemicals and dyestuff.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
常州帝通化工有限公司+86-0519-88298848 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司
Related reactions
1 records
Compound notes
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