Basic information
- CAS
1321-10-4- Standard SMILES
Oc1ccccc1CCl- InChIKey
AUESJGZPPPVYJZ-UHFFFAOYSA-N- Molecular formula
- C7H7ClO
- Average molar mass
- 142.58 g/mol
- Monoisotopic mass
- 142.0185425
Names & identifiers
- Preferred name
- 2-(Chloromethyl)phenol
- IUPAC
- 2-(chloromethyl)phenol
- English name
- o-Hydroxybenzylchloride
- Molecular formula
- C7H7ClO
- Molecular weight
- 142.58
Names & synonyms
2-(chloromethyl)phenolDTXSID70927533RefChem:1061527DTXCID90202415o-Hydroxybenzylchloride40053-98-3Phenol, 2-(chloromethyl)-SCHEMBL1234540SCHEMBL3990169SCHEMBL7050681SCHEMBL27789120AUESJGZPPPVYJZ-UHFFFAOYSA-N
Show more names
EINECS 215-309-8MFCD06136694AKOS006294222SY389141NS00120236EN300-1967059Q26841246
Database identifiers
- CAS
1321-10-4、40053-98-3- PubChem CID
- 35682
- DTXSID
DTXSID70927533- Nikkaji
- J1.593.221J
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 85
Physicochemical properties
- Boiling point
- 240.7 · 240.7±15.0 °C(Predicted)
- Density
- 1.233 · 1.233±0.06 g/cm3(Predicted)
- pka
- 9.46 · 9.46±0.35(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers10 total
湖北万得化工有限公司15377098680 15377098680 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
山东博洛达生物科技有限公司0531-68651502 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
北京科易通达科技发展有限公司17743531240 · [email protected]
上海雷祺生物科技有限公司18621609968 · [email protected]
河南拉瓦锡化工产品有限公司0371-63682289 18625781376 · [email protected]
湖北拓邦化工有限公司027-59106185 13986192185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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