Basic information
- CAS
24821-54-3- Standard SMILES
COc1ccc(C)c2ccccc12- InChIKey
DUXRFNPXLWUXMT-UHFFFAOYSA-N- Molecular formula
- C12H12O
- Average molar mass
- 172.22 g/mol
- Monoisotopic mass
- 172.088815
Names & identifiers
- Preferred name
- 4-Methoxy-1-methylnaphthalene
- IUPAC
- 1-methoxy-4-methylnaphthalene
- English name
- 4-Methoxy-1-methylnaphthalene
- Molecular formula
- C12H12O
- Molecular weight
- 172.22
Names & synonyms
24821-54-34-Methoxy-1-methylnaphthaleneDTXSID70402658RefChem:524481DTXCID50353513684-188-51-methoxy-4-methylnaphthalene1-methoxy-4-methyl-naphthaleneMFCD000214724-Methyl-1-methoxynaphthaleneSCHEMBL637625SCHEMBL637626
Show more names
Naphthalene, 1-methoxy-4-methyl-
methyl 4-methylnaphthalen-1-yl etherAKOS024324100AS-86472SY234973DB-083627M2930InChI=1/C12H12O/c1-9-7-8-12(13-2)11-6-4-3-5-10(9)11/h3-8H,1-2H
Database identifiers
- CAS
24821-54-3- PubChem CID
- 4381467
- DTXSID
DTXSID70402658- EC Number
- 684-188-5
- Nikkaji
- J455.035H
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 167
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Physicochemical properties
- Melting point
- 82 · 82-84 °C
- Boiling point
- 155 °C/15mmHg · 155°C/15mmHg(lit.)
- Density
- 1.051 · 1.051±0.06 g/cm3(Predicted)
- refractive index
- 1.616 to · 1.6160 to 1.6200
- form
- clear liquid
- color
- Light yellow to Brown
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- HS Code
- 2909.3 · 2909.30.6000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
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 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2909.30.6000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers15 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386, 800-988-0390 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
江苏艾康生物医药研发有限公司17714375163 · [email protected]
Related reactions
2 records
Compound notes
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