CAS 1012042-02-2|(S)-BnCH2-PyBox, (S,S)-2,6-Bis(4-benzylmethyl-2-oxazolin-2-yl)pyridine

Introduction：Basic information about CAS 1012042-02-2|(S)-BnCH2-PyBox, (S,S)-2,6-Bis(4-benzylmethyl-2-oxazolin-2-yl)pyridine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Safety Information
4. Articles1
5. Synonyms

Common Name	(S)-BnCH2-PyBox, (S,S)-2,6-Bis(4-benzylmethyl-2-oxazolin-2-yl)pyridine
CAS Number	1012042-02-2	Molecular Weight	425.52200
Density	1.21±0.1 g/cm3(Predicted)	Boiling Point	621.9±40.0 °C(Predicted)
Molecular Formula	C₂₇H₂₇N₃O₂	Melting Point	154-158 °C
MSDS	ChineseUSA	Flash Point	/
Symbol	GHS07	Signal Word	Warning

Names

Name	(4S)-4-(2-phenylethyl)-2-[6-[(4S)-4-(2-phenylethyl)-4,5-dihydro-1,3-oxazol-2-yl]pyridin-2-yl]-4,5-dihydro-1,3-oxazole
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.21±0.1 g/cm3(Predicted)
Boiling Point	621.9±40.0 °C(Predicted)
Melting Point	154-158 °C
Molecular Formula	C₂₇H₂₇N₃O₂
Molecular Weight	425.52200
Exact Mass	425.21000
PSA	56.07000
LogP	3.50920
InChIKey	IYRZZMJRGHERQU-GOTSBHOMSA-N
SMILES	c1ccc(CCC2COC(c3cccc(C4=NC(CCc5ccccc5)CO4)n3)=N2)cc1

Safety Information

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H315-H319-H335
Precautionary Statements	P261-P305 + P351 + P338
Personal Protective Equipment	dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes	Xi
Risk Phrases	36/37/38
Safety Phrases	26
RIDADR	NONH for all modes of transport

Articles1

Nickel-catalyzed asymmetric negishi cross-couplings of secondary allylic chlorides with alkylzincs.

J. Am. Chem. Soc. 130 , 2756, (2008)

Complementing previous advances in allylation chemistry, an effective nickel/Pybox catalyst for regioselective asymmetric Negishi cross-couplings of racemic secondary allylic chlorides with readily av...

Synonyms

(S)-BnCH2-PyBox

(S,S)-2,6-Bis(4-benzylmethyl-2-oxazolin-2-yl)pyridine

2,6-Bis((S)-4,5-dihydro-4-phenethyloxazol-2-yl)pyridine

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