2-(2-Chlorophenoxy)acetamidine Hydrochloride - CAS 58403-03-5
Catalog: |
BB030027 |
Product Name: |
2-(2-Chlorophenoxy)acetamidine Hydrochloride |
CAS: |
58403-03-5 |
Synonyms: |
2-(2-chlorophenoxy)ethanimidamide;hydrochloride; 2-(2-chlorophenoxy)ethanimidamide;hydrochloride |
IUPAC Name: | 2-(2-chlorophenoxy)ethanimidamide;hydrochloride |
Description: | 2-(2-Chlorophenoxy)acetamidine Hydrochloride (CAS# 58403-03-5) is a useful research chemical. |
Molecular Weight: | 221.08 |
Molecular Formula: | C8H10Cl2N2O |
Canonical SMILES: | C1=CC=C(C(=C1)OCC(=N)N)Cl.Cl |
InChI: | InChI=1S/C8H9ClN2O.ClH/c9-6-3-1-2-4-7(6)12-5-8(10)11;/h1-4H,5H2,(H3,10,11);1H |
InChI Key: | WPWKAEFYVGWTAE-UHFFFAOYSA-N |
Boiling Point: | 303.6 °C at 760 mmHg |
MDL: | MFCD00173805 |
LogP: | 3.25680 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-1232199-A | Method of virtual retrieval of analogs of lead compounds | 19971104 |
AU-746833-B2 | Method of virtual retrieval of analogs of lead compounds | 19971104 |
CA-2306822-A1 | Method of virtual retrieval of analogs of lead compounds | 19971104 |
EP-1029297-A2 | Method of virtual retrieval of analogs of lead compounds | 19971104 |
EP-1029297-B1 | Method of virtual retrieval of analogs of lead compounds | 19971104 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.0170183 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.0170183 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 59.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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