2-Chloro-3-nitroaniline - CAS 3970-41-0
Catalog: |
BB024091 |
Product Name: |
2-Chloro-3-nitroaniline |
CAS: |
3970-41-0 |
Synonyms: |
2-chloro-3-nitroaniline; 2-chloro-3-nitroaniline |
IUPAC Name: | 2-chloro-3-nitroaniline |
Description: | 2-Chloro-3-nitroaniline (CAS# 3970-41-0) is a useful research chemical. |
Molecular Weight: | 172.57 |
Molecular Formula: | C6H5ClN2O2 |
Canonical SMILES: | C1=CC(=C(C(=C1)[N+](=O)[O-])Cl)N |
InChI: | InChI=1S/C6H5ClN2O2/c7-6-4(8)2-1-3-5(6)9(10)11/h1-3H,8H2 |
InChI Key: | CMYQDOILKQVRGN-UHFFFAOYSA-N |
LogP: | 2.93480 |
Publication Number | Title | Priority Date |
US-2020407344-A1 | Compounds for the treatment of braf-associated diseases and disorders | 20190628 |
WO-2020261156-A1 | Quinazolin-4-one derivatives useful for the treatment of braf-associated diseases and disorders | 20190628 |
CN-111454218-A | 2,4, 5-substituted pyrimidine compound and preparation method and application thereof | 20190122 |
US-2018259403-A1 | UV Cured Indicating Devices | 20150510 |
WO-2016183044-A1 | Uv cured indicating devices | 20150510 |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.0039551 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.0039551 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 71.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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