Basic information
- CAS
66924-20-7- Standard SMILES
CCCCOc1cc(C(=O)O)ccc1OC- InChIKey
MVXLURPNIOZKDD-UHFFFAOYSA-N- Molecular formula
- C12H16O4
- Average molar mass
- 224.25 g/mol
- Monoisotopic mass
- 224.10485899
Names & identifiers
- Preferred name
- 3-Butoxy-4-methoxybenzoic acid
- IUPAC
- 3-butoxy-4-methoxybenzoic acid
- English name
- 3-BUTOXY-4-METHOXYBENZOIC ACID
- Molecular formula
- C12H16O4
- Molecular weight
- 224.25
Names & synonyms
3-butoxy-4-methoxybenzoic acid66924-20-7DTXSID80370859RefChem:277916DTXCID50321893629-975-63-n-Butoxy-4-methoxybenzoic acidMFCD00831065Benzoic acid, 3-butoxy-4-methoxy-Maybridge1_0051493-BUTOXY-4-METHOXYBENZOICACIDSCHEMBL3884522
Show more names
BUTTPARK 95\04-28
3-butoxy-4-methoxy-benzoic acidHMS556C01CCG-42150SBB096647AKOS000182971KM 09976DB-017731CS-0359788
Database identifiers
- CAS
66924-20-7- PubChem CID
- 2735652
- DTXSID
DTXSID80370859- EC Number
- 629-975-6
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 217
Physicochemical properties
- Melting point
- 142 °C · 142 °C
- CAS DataBase Reference
- 66924 · 66924-20-7
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Hazard Codes
- C,Xn
- Risk Statements
- 22 · 22-36
- Safety Statements
- 26 · 26
- Hazard Note
- Corrosive
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- risk_code
- 22-36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- C,Xn
- hazard_note
- Corrosive
- safety_code
- 26
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers9 total
山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
菏泽书颖生物科技有限公司18553078733 · [email protected]
山东碳氢生物化工有限公司13060081947 13060081947 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…