2-Amino-4,5-dichloropyrimidine - CAS 403854-21-7
Catalog: |
BB024478 |
Product Name: |
2-Amino-4,5-dichloropyrimidine |
CAS: |
403854-21-7 |
Synonyms: |
4,5-dichloro-2-pyrimidinamine; 4,5-dichloropyrimidin-2-amine |
IUPAC Name: | 4,5-dichloropyrimidin-2-amine |
Description: | 2-Amino-4,5-dichloropyrimidine (CAS# 403854-21-7) is a useful research chemical. |
Molecular Weight: | 163.99 |
Molecular Formula: | C4H3Cl2N3 |
Canonical SMILES: | C1=C(C(=NC(=N1)N)Cl)Cl |
InChI: | InChI=1S/C4H3Cl2N3/c5-2-1-8-4(7)9-3(2)6/h1H,(H2,7,8,9) |
InChI Key: | LCNPRNSOGSLJFZ-UHFFFAOYSA-N |
Boiling Point: | 352.5 °C at 760 mmHg |
Density: | 1.606 g/cm3 |
MDL: | MFCD13193667 |
LogP: | 1.94680 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113121528-A | Multi-target inhibition compound, composition, functional molecule and application thereof | 20200115 |
WO-2021143729-A1 | Compound, composition and functional molecule with multi-target inhibiting effect and use thereof | 20200115 |
WO-2021048342-A1 | Antibacterial compounds | 20190913 |
CN-105769871-A | Application of NIK protein kinase inhibitor in serving as medicine for treating liver diseases | 20160303 |
WO-2017041771-A1 | Process for the preparation of ceritinib using "in situ" prepared 5-methyl-2-(1 -methylethoxy)-4-(4-piperidinyl)-benzenamine monohydrochloride (1 :1 ) as an intermediate | 20150909 |
Complexity: | 99.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.9704025 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.9704025 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 51.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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