D-Phenylglycinol - CAS 56613-80-0

Catalog:	BB029421
Product Name:	D-Phenylglycinol
CAS:	56613-80-0
Synonyms:	H-D-Phg-ol; (R)-2-Amino-2-phenylethanol; (R)-(-)-2-Phenylglycinol; (R)-2-Phenylglycinol

Technical Data

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Computed Properties

IUPAC Name:	(2R)-2-amino-2-phenylethanol
Description:	A chiral building block for the synthesis of novel fluorescent chemosensors for amino acid.
Molecular Weight:	137.2
Molecular Formula:	C8H11NO
Canonical SMILES:	C1=CC=C(C=C1)C(CO)N
InChI:	InChI=1S/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2/t8-/m0/s1
InChI Key:	IJXJGQCXFSSHNL-QMMMGPOBSA-N
Boiling Point:	261 °C at 760 mmHg
Melting Point:	72-82 °C
Purity:	≥ 99 %
Density:	1.104 g/cm³
Appearance:	White to pale yellow crystalline solid
Storage:	Store at 2-8 °C
MDL:	MFCD00008062
LogP:	1.37900

Publication Number	Title	Priority Date
WO-2021113806-A1	Arylamides and methods of use thereof	20191205
WO-2021113808-A1	Cftr-modulating arylamides	20191205
WO-2021113809-A1	Arylamides and methods of use thereof	20191205
US-2020085832-A1	Deuterated analogs of an organic compound	20191122
WO-2021102221-A1	Deuterated analogs of an idh1 inhibitor	20191122

PMID	Publication Date	Title	Journal
22343081	20120501	New modulated design and synthesis of chiral CuII/SnIV bimetallic potential anticancer drug entity: in vitro DNA binding and pBR322 DNA cleavage activity	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy
22334380	20120319	Stereoselective access to fluorinated and non-fluorinated quaternary piperidines: synthesis of pipecolic acid and iminosugar derivatives	Chemistry (Weinheim an der Bergstrasse, Germany)
22133083	20120106	A practical synthetic route to enantiopure 6-substituted cis-decahydroquinolines	Organic letters
21945056	20111202	De novo design of chiral organotin cancer drug candidates: validation of enantiopreferential binding to molecular target DNA and 5'-GMP by UV-visible, fluorescence, (1)H and (31)P NMR	Journal of photochemistry and photobiology. B, Biology
21462951	20110506	Cyclohydrocarbonylation-based strategy toward poly-substituted piperidines	Organic letters

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	89.3
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	137.084063974
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	137.084063974
Rotatable Bond Count:	2
Topological Polar Surface Area:	46.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1