Basic information
- CAS
70476-61-8- Standard SMILES
CCC(C)Oc1ccc(O)cc1- InChIKey
ODJNFFWBHMBEMA-UHFFFAOYSA-N- Molecular formula
- C10H14O2
- Average molar mass
- 166.22 g/mol
- Monoisotopic mass
- 166.09937969
Names & identifiers
- Preferred name
- 4-(1-Methyl-1-propyloxy)-phenol
- IUPAC
- 4-butan-2-yloxyphenol
- English name
- Phenol, 4-(1-methylpropoxy)-
- Molecular formula
- C10H14O2
- Molecular weight
- 166.21696
Names & synonyms
4-(Butan-2-yloxy)phenol70476-61-84-(1-methyl-1-propyloxy)-phenol4-butan-2-yloxyphenolPhenol, 4-(1-methylpropoxy)-4-sec-butoxyphenolPramoxine Impurity 44-sec-butyloxyphenol4-(sec-butyloxy)-phenol4-(1-methylpropoxy)phenol4-(SEC-BUTOXY)PHENOL4-[(Butan-2-yl)oxy]phenol
Show more names
RMA-8Pramoxine-004
SCHEMBL1806289SCHEMBL3170733DTXSID60551821ODJNFFWBHMBEMA-UHFFFAOYSA-NVCA47661AKOS009315300CS-0225250G45107
Database identifiers
- CAS
70476-61-8- PubChem CID
- 13882004
- DTXSID
DTXSID60551821
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 117
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers5 total
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
山东诚创蓝海医药科技有限公司0531-58897130 15508676053 · [email protected]
四川嘉瑛莱科技有限责任公司028-64159575 · [email protected]
广州市震霖医药科技有限公司18102736234 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
37 records
Compound notes
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