(S)-(+)-1-phenylpropan-2-ol - CAS 1517-68-6
Catalog: |
BB050252 |
Product Name: |
(S)-(+)-1-phenylpropan-2-ol |
CAS: |
1517-68-6 |
Synonyms: |
(S)-1-Phenyl-2-propanol; (S)-1-Phenylpropan-2-ol; (S)-(+)-1-Phenyl-2-propanol |
IUPAC Name: | (2S)-1-phenylpropan-2-ol |
Description: | (S)-(+)-1-phenylpropan-2-ol (CAS# 1517-68-6 ) is a useful research chemical. |
Molecular Weight: | 136.19 |
Molecular Formula: | C9H12O |
Canonical SMILES: | CC(CC1=CC=CC=C1)O |
InChI: | InChI=1S/C9H12O/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3/t8-/m0/s1 |
InChI Key: | WYTRYIUQUDTGSX-QMMMGPOBSA-N |
Boiling Point: | 220 °C at 760 mmHg |
Purity: | ≥ 98 %, ≥ 95 % e.e. |
Density: | 0.996 g/cm3 |
Appearance: | Colorless liquid |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | 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 |
Signal Word: | Warning |
Complexity: | 84.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 136.088815002 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 136.088815002 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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