Basic information
- CAS
18272-84-9- Standard SMILES
CCCCc1ccc(OC)cc1- InChIKey
PRBLRGZSVKMPDX-UHFFFAOYSA-N- Molecular formula
- C11H16O
- Average molar mass
- 164.24 g/mol
- Monoisotopic mass
- 164.12011513
Names & identifiers
- Preferred name
- Benzene, 1-butyl-4-methoxy-
- IUPAC
- 1-butyl-4-methoxybenzene
- English name
- 4-Butylanisole
- Molecular formula
- C11H16O
- Molecular weight
- 164.24
Names & synonyms
Benzene, 1-butyl-4-methoxy-18272-84-9DTXSID40171324NSC 31625RefChem:117315DTXCID8093815PRBLRGZSVKMPDX-UHFFFAOYSA-N1-Butyl-4-methoxybenzene4-BUTYLANISOLE1219804-78-04-n-Butylanisole--d41-butyl-4-methoxy-benzene
Show more names
1-Methoxy-4-butylbenzene
p-ButylanisolNSC316251-Butyl-4-methoxybenzene #SCHEMBL145506SCHEMBL293710SCHEMBL1047372SCHEMBL1119420SCHEMBL3085735
Database identifiers
- CAS
18272-84-9- PubChem CID
- 140362
- DTXSID
DTXSID40171324- Nikkaji
- J126.139H
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 104
Physicochemical properties
- Melting point
- 78 · 78-79 °C
- Boiling point
- 120 °C · 120 °C(Press: 19 Torr)
- Density
- 0.9273 g/cm3 · 0.9273 g/cm3(Temp: 25 °C)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
盐城通铭生物科技有限公司15195160625 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
烟台显华科技集团股份有限公司18754503080 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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