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Cas Database

Name

(S,S)-2,2'-Isopropylidene-bis(4-phenyl-2-oxazoline)

EINECS

N/A

CAS No.

131457-46-0

Density

1.18g/cm³

PSA

43.18000

LogP

3.22380

Solubility

N/A

Melting Point

37-41 °C(lit.)

Formula

C21H22 N2 O2

Boiling Point

193 °C0.03 mm Hg(lit.)

Molecular Weight

334.418

Flash Point

110 ºC

Transport Information

N/A

Appearance

N/A

Safety

Risk Statements	36/37/38
Safety Statements	22-24/25
WGK Germany	3
F	10

Risk Codes

36/37/38

Molecular Structure

Hazard Symbols

N/A

Synonyms

Oxazole,2,2'-(1-methylethylidene)bis[4,5-dihydro-4-phenyl-, [S-(R*,R*)]-; (4S,4'S)-2,2'-(1-Methylethylidene)bis[4,5-dihydro-4-phenyloxazole];(S,S)-2,2'-Isopropylidenebis[4-phenyl-2-oxazoline]; (S,S)-PhBox;(S,S)-Phenyl-Box; 2,2-Bis((4S)-4,5-dihydro-4-phenyloxazol-2-yl)propane;2,2-Bis((S)-4-phenyl-2-oxazolin-2-yl)propane; 2,2'-(S)-Isopropylidene-bis(4-phenyl-2-oxazoline)

Article Data

(S,S)-2,2'-Isopropylidene-bis(4-phenyl-2-oxazoline) Chemical Properties

Molecular structure of (S,S)-2,2'-Isopropylidene-bis(4-phenyl-2-oxazoline) (CAS NO.131457-46-0) is:

Product Name: (S,S)-2,2'-Isopropylidene-bis(4-phenyl-2-oxazoline)
CAS Registry Number: 131457-46-0
Systematic Name: (4S,4'S)-2,2'-propane-2,2-diylbis(4-phenyl-4,5-dihydro-1,3-oxazole)
Melting Point: 37-41 °C(lit.)
Alpha: -150 °(C=1% IN ETOH)
Refractive index: -155 ° (C=1, EtOH)
Storage temp.: -20°C
Index of Refraction: 1.611
Molar Refractivity: 98.18 cm³
Molar Volume: 282.5 cm³
Surface Tension: 43 dyne/cm
Density: 1.18 g/cm³
Flash Point: 190.5 °C
Enthalpy of Vaporization: 70.32 kJ/mol
Boiling Point: 468.9 °C at 760 mmHg
Vapour Pressure: 1.62E-08 mmHg at 25 °C
Product Categories: Asymmetric Synthesis;Synthetic Organic Chemistry
SMILES: N\1=C(\OC[C@@H]/1c2ccccc2)C(C/4=N/[C@@H](c3ccccc3)CO\4)(C)C
InChI: InChI=1/C21H22N2O2/c1-21(2,19-22-17(13-24-19)15-9-5-3-6-10-15)20-23-18(14-25-20)16-11-7-4-8-12-16/h3-12,17-18H,13-14H2,1-2H3/t17-,18-/m1/s1
InChIKey: JTNVCJCSECAMLD-QZTJIDSGBD
Std. InChI: InChI=1S/C21H22N2O2/c1-21(2,19-22-17(13-24-19)15-9-5-3-6-10-15)20-23-18(14-25-20)16-11-7-4-8-12-16/h3-12,17-18H,13-14H2,1-2H3/t17-,18-/m1/s1
Std. InChIKey: JTNVCJCSECAMLD-QZTJIDSGSA-N

(S,S)-2,2'-Isopropylidene-bis(4-phenyl-2-oxazoline) Safety Profile

Safty information about (S,S)-2,2'-Isopropylidene-bis(4-phenyl-2-oxazoline) (CAS NO.131457-46-0) is:
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 22-24/25
S22:Do not breathe dust.
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3
F: 10

(S,S)-2,2'-Isopropylidene-bis(4-phenyl-2-oxazoline) Specification

(S,S)-2,2'-Isopropylidene-bis(4-phenyl-2-oxazoline) , its cas register number is 131457-46-0. It also can be called (S,S)-2,2-Bis(4-phenyl-2-oxazolin-2-yl)propane; (-)-2,2'-Isopropylidenebis[(4S)-4-phenyl-2-oxazoline] ; Oxazole,2,2'-(1-methylethylidene)bis[4,5-dihydro-4-phenyl-, (4S,4'S)- .

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