| CAS Number | 85474-76-6 |
| Catalog Number | AG00G4QF(AGN-PC-0N4629) |
| Chemical Name | 2-Chloro-4-piperazin-1-ylphenol |
| IUPAC Name | 2-chloro-4-piperazin-1-ylphenol |
| InChI | InChI=1S/C10H13ClN2O/c11-9-7-8(1-2-10(9)14)13-5-3-12-4-6-13/h1-2,7,12,14H,3-6H2 |
| InChI Key | FXECOYYRPDGOQB-UHFFFAOYSA-N |
| MDL Number | MFCD16251307 |
| Molecular Formula | C10H13ClN2O |
| Molecular Weight | 212.676 |
| SMILES | OC1=C(Cl)C=C(N2CCNCC2)C=C1 |
| UNII | 40ARJ48C0C |
| Synonyms | 85474-76-6,
2-CHLORO-4-PIPERAZIN-1-YLPHENOL,
UNII-40ARJ48C0C,
p-Hydroxy-meta-chlorophenylpiperazine,
Phenol, 2-chloro-4-(1-piperazinyl)-,
40ARJ48C0C,
2-chloro-4-(piperazin-1-yl)phenol,
SCHEMBL2738997,
DTXSID50234691,
2-Chloro-4-(1-piperazinyl)phenol,
ZINC38812641,
4-(3-Chloro-4-hydroxyphenyl)piperazine,
FT-0664924,
2-chloro-4-piperazin-1-yl-phenol,
1-(3-chloro-4-hydroxyphenyl)piperazine,
CID10420741,
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.677g/mol |
| Monoisotopic Mass | 212.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number