1-[4-(Chloromethyl)phenyl]pyrazole Hydrochloride - CAS 1052543-40-4
Catalog: |
BB001589 |
Product Name: |
1-[4-(Chloromethyl)phenyl]pyrazole Hydrochloride |
CAS: |
1052543-40-4 |
Synonyms: |
1-[4-(chloromethyl)phenyl]pyrazole;hydrochloride; 1-[4-(chloromethyl)phenyl]pyrazole;hydrochloride |
IUPAC Name: | 1-[4-(chloromethyl)phenyl]pyrazole;hydrochloride |
Description: | 1-[4-(Chloromethyl)phenyl]pyrazole Hydrochloride (CAS# 1052543-40-4 ) is a useful research chemical. |
Molecular Weight: | 229.11 |
Molecular Formula: | C10H10Cl2N2 |
Canonical SMILES: | C1=CN(N=C1)C2=CC=C(C=C2)CCl.Cl |
InChI: | InChI=1S/C10H9ClN2.ClH/c11-8-9-2-4-10(5-3-9)13-7-1-6-12-13;/h1-7H,8H2;1H |
InChI Key: | RIQNXRNDFBPZOM-UHFFFAOYSA-N |
LogP: | 3.41310 |
Complexity: | 155 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.0221037 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.0221037 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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