Basic information
- CAS
16929-64-9- Standard SMILES
CCCc1c(OC)cccc1OC- InChIKey
FWIVQKGKHLKKCW-UHFFFAOYSA-N- Molecular formula
- C11H16O2
- Average molar mass
- 180.24 g/mol
- Monoisotopic mass
- 180.11502975
Names & identifiers
- Preferred name
- 1,3-Dimethoxy-2-propylbenzene
- IUPAC
- 1,3-dimethoxy-2-propylbenzene
- English name
- 1,3-dimethoxy-2-propylbenzene
- Molecular formula
- C11H16O2
- Molecular weight
- 180.24
Names & synonyms
1,3-dimethoxy-2-propylbenzene16929-64-9Benzene, 1,3-dimethoxy-2-propyl2-Propyl-1,3-dimethoxybenzeneSCHEMBL8405936SCHEMBL8564056SCHEMBL8583058SCHEMBL280451762,4,-Dimethoxy-3-propylbenzeneDTXSID703353711,3-Dimethoxy-2-(n-propyl)benzeneMFCD12828146
Show more names
Benzene,1,3-dimethoxy-2-propyl-1,3-DiMethoxy-2-(prop-1'-yl)benzene
AKOS015843321
Database identifiers
- CAS
16929-64-9- PubChem CID
- 524857
- DTXSID
DTXSID70335371
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 124
Physicochemical properties
- Boiling point
- 241.2 · 241.2±20.0 °C(Predicted)
- Density
- 0.965 · 0.965±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
Chemistry & industry
Suppliers7 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
11 records
Compound notes
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