3-(Trifluoromethyl)pyrrolidin-3-ol Hydrochloride - CAS 1334147-81-7
Catalog: |
BB007751 |
Product Name: |
3-(Trifluoromethyl)pyrrolidin-3-ol Hydrochloride |
CAS: |
1334147-81-7 |
Synonyms: |
3-(trifluoromethyl)-3-pyrrolidinol;hydrochloride; 3-(trifluoromethyl)pyrrolidin-3-ol;hydrochloride |
IUPAC Name: | 3-(trifluoromethyl)pyrrolidin-3-ol;hydrochloride |
Description: | 3-(Trifluoromethyl)pyrrolidin-3-ol Hydrochloride (CAS# 1334147-81-7) is a useful research chemical. |
Molecular Weight: | 191.58 |
Molecular Formula: | C5H9ClF3NO |
Canonical SMILES: | C1CNCC1(C(F)(F)F)O.Cl |
InChI: | InChI=1S/C5H8F3NO.ClH/c6-5(7,8)4(10)1-2-9-3-4;/h9-10H,1-3H2;1H |
InChI Key: | QDJSEILRWZMZFQ-UHFFFAOYSA-N |
LogP: | 1.40390 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3800188-A1 | Substituted pyrazolopyrimidines as irak4 inhibitors | 20191002 |
WO-2021064077-A1 | Substituted pyrazolopyrimidines as irak4 inhibitors | 20191002 |
CA-3079770-A1 | Amine substituted triazole derivatives and uses thereof | 20171024 |
WO-2019081299-A1 | AMINE SUBSTITUTED TRIAZOLE DERIVATIVES AND USES THEREOF | 20171024 |
WO-2019081307-A1 | SUBSTITUTED TRIAZOLE DERIVATIVES AND USES THEREOF | 20171024 |
Complexity: | 135 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.0324761 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.0324761 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 32.3 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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