1-(2,2-Difluoroethyl)-1H-pyrazol-3-amine - CAS 1006462-38-9
Catalog: |
BB000282 |
Product Name: |
1-(2,2-Difluoroethyl)-1H-pyrazol-3-amine |
CAS: |
1006462-38-9 |
Synonyms: |
1-(2,2-difluoroethyl)-3-pyrazolamine; 1-(2,2-difluoroethyl)pyrazol-3-amine |
IUPAC Name: | 1-(2,2-difluoroethyl)pyrazol-3-amine |
Description: | 1-(2,2-Difluoroethyl)-1H-pyrazol-3-amine (CAS# 1006462-38-9) is a useful research chemical. |
Molecular Weight: | 147.13 |
Molecular Formula: | C5H7F2N3 |
Canonical SMILES: | C1=CN(N=C1N)CC(F)F |
InChI: | InChI=1S/C5H7F2N3/c6-4(7)3-10-2-1-5(8)9-10/h1-2,4H,3H2,(H2,8,9) |
InChI Key: | IEUJFYRUNRRGQY-UHFFFAOYSA-N |
LogP: | 0.66050 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020247819-A2 | Methods of treatment with aminolevulinic acid synthase 2 (alas2) modulators | 20190607 |
EA-034781-B1 | Aryl, heteroaryl and heterocyclic compounds for the treatment of disorder mediated by complement factor D | 20150826 |
JP-2018526367-A | Aryl, heteroaryl and heterocyclic compounds for the treatment of medical disorders | 20150826 |
KR-20180043343-A | Aryl, heteroaryl, and heterocyclic compounds for the treatment of medical disorders | 20150826 |
TW-201722932-A | Aryl, heteroaryl and heterocyclic compounds for the treatment of medical conditions | 20150826 |
Complexity: | 109 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 147.06080356 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 147.06080356 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 43.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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