(1S)-1-(2-methoxyphenyl)ethan-1-ol
Basic information
- CAS
108100-06-7- Standard SMILES
COc1ccccc1[C@H](C)O- InChIKey
DDUBOVLGCYUYFX-LURJTMIESA-N- Molecular formula
- C9H12O2
- Average molar mass
- 152.19 g/mol
- Monoisotopic mass
- 152.08372962
Names & identifiers
- Preferred name
- (1S)-1-(2-methoxyphenyl)ethan-1-ol
- IUPAC
- (1S)-1-(2-methoxyphenyl)ethanol
- English name
- (S)-1-(2-chlorophenyl)ethanol
- Molecular formula
- C9H12O2
- Molecular weight
- 152.19
Names & synonyms
108100-06-7(1S)-1-(2-methoxyphenyl)ethan-1-olRefChem:393675859-825-7(S)-1-(2-Methoxyphenyl)ethanol(1S)-1-(2-methoxyphenyl)ethanol(S)-1-(2-methoxyphenyl)ethan-1-olBenzenemethanol, 2-methoxy-a-methyl-, (aS)-SCHEMBL3929903(s)-1-(2-methoxy-phenyl)-ethanolMFCD09863656AKOS016843339
Show more names
Benzenemethanol, 2-methoxy-α-methyl-, (αS)-
SY186869DB-328044EN300-82469(alphaS)-2-Methoxy-alpha-methylbenzenemethanolG56682F898515Benzenemethanol, 2-methoxy-alpha-methyl-, (alphaS)-Z360055194
Database identifiers
- CAS
108100-06-7- PubChem CID
- 7058089
- EC Number
- 859-825-7
- Nikkaji
- J231.903I
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 114
Physicochemical properties
- Boiling point
- 236 ℃ · 236℃
- Density
- 1.053 · 1.053
- Flash point
- 111 ℃ · 111℃
- storage temp.
- 2 · 2-8°C
- pka
- 14.49 · 14.49±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Suppliers
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Related reactions
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Compound notes
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