(4S,5R)-4,5-bis(3-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-one

Modify Date: 2025-08-25 19:04:35

(4S,5R)-4,5-bis(3-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-one Structure
(4S,5R)-4,5-bis(3-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-one structure
Common Name (4S,5R)-4,5-bis(3-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-one
CAS Number 107659-76-7 Molecular Weight 390.22000
Density 1.48g/cm3 Boiling Point 616.5ºC at 760 mmHg
Molecular Formula C18H13Cl2N3O3 Melting Point N/A
MSDS N/A Flash Point 326.7ºC

 Names

Name (4S,5R)-4,5-bis(3-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-one

 Chemical & Physical Properties

Density 1.48g/cm3
Boiling Point 616.5ºC at 760 mmHg
Molecular Formula C18H13Cl2N3O3
Molecular Weight 390.22000
Flash Point 326.7ºC
Exact Mass 389.03300
PSA 66.24000
LogP 4.38850
Vapour Pressure 3.93E-15mmHg at 25°C
Index of Refraction 1.675
InChIKey VXUWLZQPINPMDL-SJLPKXTDSA-N
SMILES O=C1OC(c2cccc(Cl)c2)C(Cn2cncn2)(c2cccc(Cl)c2)O1

 Synthetic Route

~56%

(4S,5R)-4,5-bis(3-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-one Structure

(4S,5R)-4,5-bis...

CAS#:107659-76-7

Literature: Ogata; Matsumoto; Takahashi; Shimizu; Kida; Murabayashi; Shiro; Tawara Journal of Medicinal Chemistry, 1987 , vol. 30, # 6 p. 1054 - 1068

~%

(4S,5R)-4,5-bis(3-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-one Structure

(4S,5R)-4,5-bis...

CAS#:107659-76-7

Literature: Ogata; Matsumoto; Takahashi; Shimizu; Kida; Murabayashi; Shiro; Tawara Journal of Medicinal Chemistry, 1987 , vol. 30, # 6 p. 1054 - 1068

~%

(4S,5R)-4,5-bis(3-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-one Structure

(4S,5R)-4,5-bis...

CAS#:107659-76-7

Literature: Ogata; Matsumoto; Takahashi; Shimizu; Kida; Murabayashi; Shiro; Tawara Journal of Medicinal Chemistry, 1987 , vol. 30, # 6 p. 1054 - 1068

~%

(4S,5R)-4,5-bis(3-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-one Structure

(4S,5R)-4,5-bis...

CAS#:107659-76-7

Literature: Ogata; Matsumoto; Takahashi; Shimizu; Kida; Murabayashi; Shiro; Tawara Journal of Medicinal Chemistry, 1987 , vol. 30, # 6 p. 1054 - 1068
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