Basic information
- CAS
1269773-21-8- Standard SMILES
Cl.N[C@H](CO)c1ccc(F)cc1- InChIKey
XDUGHEJDMDUTSI-DDWIOCJRSA-N- Molecular formula
- C8H11ClFNO
- Average molar mass
- 191.63 g/mol
- Monoisotopic mass
- 191.05131987
Names & identifiers
- Preferred name
- (S)-2-Amino-2-(4-fluorophenyl)ethanol hydrochloride
- IUPAC
- (2S)-2-amino-2-(4-fluorophenyl)ethanol;hydrochloride
- English name
- (S)-2-AMino-2-(4-fluorophenyl)ethanol hydrochloride
- Molecular formula
- C8H10FNO
- Molecular weight
- 155.1695032
Names & synonyms
1269773-21-8(S)-2-Amino-2-(4-fluorophenyl)ethanol hydrochlorideMFCD12758115(2S)-2-amino-2-(4-fluorophenyl)ethanol;hydrochloride(S)-2-amino-2-(4-fluorophenyl)ethan-1-ol hydrochloride(S)-2-Amino-2-(4-fluorophenyl)ethanol HClBenzeneethanol, beta-amino-4-fluoro-, hydrochloride (1:1), (betaS)-(2S)-2-amino-2-(4-fluorophenyl)ethan-1-ol hydrochloride(S)-2-Amino-2-(4-fluorophenyl)ethanolhydrochloride(2S)-2-amino-2-(4-fluorophenyl)ethanol,hydrochlorideSCHEMBL1439114DTXSID70736243
Show more names
(2S)-2-AMINO-2-(4-FLUOROPHENYL)ETHAN-1-OL-HClBenzeneethanol, β-amino-4-fluoro-, hydrochloride (1:1), (βS)-
XDUGHEJDMDUTSI-DDWIOCJRSA-NUAC77321AKOS016013062GS-7159SY111332DB-336331CS-0089922I11004
Database identifiers
- CAS
1269773-21-8
Properties
Computed structural properties
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 113
Physicochemical properties
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Appearance
- White to off-white Solid
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers27 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
郑州药领医药科技有限公司13526569071 · [email protected]
石家庄州昆医药科技有限公司0311-83784138 18633934202 · [email protected]
南京友杰医药科技有限公司18860950986 · [email protected]
上海裕兰生物科技有限公司021-57171705 13817537615 · [email protected]
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
重庆艾思摩尔科技有限公司023-86822659 18611316925 · [email protected]
天津星瀚生物科技有限公司13230698506 18698089028 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
西安峥鎏生物科技有限公司15594552852 · [email protected]
Related reactions
1 records
Compound notes
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