3-(3-Nitrophenyl)-1H-pyrazole - CAS 59843-77-5
Catalog: |
BB030525 |
Product Name: |
3-(3-Nitrophenyl)-1H-pyrazole |
CAS: |
59843-77-5 |
Synonyms: |
5-(3-nitrophenyl)-1H-pyrazole |
IUPAC Name: | 5-(3-nitrophenyl)-1H-pyrazole |
Description: | 3-(3-Nitrophenyl)-1H-pyrazole (CAS# 59843-77-5) is a useful research chemical. |
Molecular Weight: | 189.17 |
Molecular Formula: | C9H7N3O2 |
Canonical SMILES: | C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=NN2 |
InChI: | InChI=1S/C9H7N3O2/c13-12(14)8-3-1-2-7(6-8)9-4-5-10-11-9/h1-6H,(H,10,11) |
InChI Key: | RUWXJVIBNZSEQD-UHFFFAOYSA-N |
Boiling Point: | 428.7 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.369 g/cm3 |
MDL: | MFCD00106146 |
LogP: | 2.50810 |
GHS Hazard Statement: | H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (20%): 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 (20%): 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-2019165158-A1 | Il-6 inhibitors and methods of treatment | 20180222 |
US-2021206718-A1 | Il-6 inhibitors and methods of treatment | 20180222 |
BR-112020015072-A2 | PROTEIN KINASE MKK4 INHIBITORS TO PROMOTE LIVER REGENERATION, OR REDUCE, OR PREVENT HEPATOCYT DEATH | 20180131 |
EP-2493858-A1 | Androgen receptor modulating compounds | 20091027 |
WO-2011051540-A1 | Androgen receptor modulating compounds | 20091027 |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.053826475 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.053826475 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 74.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
-
Catalog: BB050789
(1,4-Dimethyl-1H-pyrazol-5-yl)methanol
Detail
-
Catalog: BB053510
(1,3-Dimethyl-1H-pyrazol-4-yl)methylamine hydrochloride
Detail
-
Catalog: BB045656
([5-(1-Ethyl-1H-pyrazol-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]thio)acetic acid
Detail
-
Catalog: BB050063
(1,3-Dimethyl-1H-pyrazole-5-yl)methanol
Detail
-
Catalog: BB050668
(1-(2,2,2-Trifluoroethyl)-1H-pyrazol-4-yl)methanol
Detail
-
Catalog: BB047223
(1,3-Dimethyl-1H-pyrazol-5-yl)methanamine
Detail
-
Catalog: BB045250
(1,3-Diphenyl-1H-pyrazol-4-yl)methylamine
Detail
-
Catalog: BB052887
(1,5-Diethylpyrazol-4-yl)methylamine
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Pyrazoles
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS