2-[4-(4-chlorophenyl)piperazin-1-yl]ethanol(CAS No. 55179-20-9) CAS NO.55179-20-9

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Product Details

Keywords

2-[4-(4-chlorophenyl)piperazin-1-yl]ethanol
55179-20-9
98%

Quick Details

ProName: 2-[4-(4-chlorophenyl)piperazin-1-yl]et...
CasNo: 55179-20-9
Molecular Formula: C12H17ClN2O
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: According to client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 100 Kilogram/Month
Purity: 99%
Storage: room temperature
Transportation: as requested
LimitNum: 1 Gram

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Details

【Name】
2-[4-(4-chlorophenyl)piperazin-1-yl]ethanol
【Iupac name】
2-[4-(4-chlorophenyl)piperazin-1-yl]ethanol
【CAS Registry number】
55179-20-9
【Synonyms】
2-[4-(4-chlorophenyl)piperazin-1-yl]ethanol
55179-20-9
NSC86986
AC1L5YGJ
AC1Q3RA4
NCIOpen2_005211
AR-1D6872
NSC-86986
AG-J-28910
【Molecular Formula】
C12H17ClN2O (Products with the same molecular formula)
【Molecular Weight】
240.7292
【Inchi】
InChI=1/C12H17ClN2O/c13-11-1-3-12(4-2-11)15-7-5-14(6-8-15)9-10-16/h1-4,16H,5-10H2
【Canonical SMILES】
C1CN(CCN1CCO)C2=CC=C(C=C2)Cl
Chemical and Physical Properties
【Density】
1.204g/cm3
【Boiling Point】
397.2°C at 760 mmHg
【Refractive Index】
1.572
【Flash Point】
194°C
【Computed Properties】
Molecular Weight:240.72918 [g/mol]
Molecular Formula:C12H17ClN2O
XLogP3-AA:1.8
H-Bond Donor:1
H-Bond Acceptor:3
Rotatable Bond Count:3
Exact Mass:240.102941
MonoIsotopic Mass:240.102941
Topological Polar Surface Area:26.7
Heavy Atom Count:16
Formal Charge:0
Complexity:199
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Cation Count:2
Feature 3D Ring Count:2
Effective Rotor Count:4.2
Conformer Sampling RMSD:0.6
CID Conformer Count:23

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