3α,4β,15-tris(chloroacetoxy)scirpene

Modify Date: 2024-09-15 18:13:34

3α,4β,15-tris(chloroacetoxy)scirpene Structure
3α,4β,15-tris(chloroacetoxy)scirpene structure
Common Name 3α,4β,15-tris(chloroacetoxy)scirpene
CAS Number 80178-18-3 Molecular Weight 511.77700
Density 1.46g/cm3 Boiling Point 574.5ºC at 760 mmHg
Molecular Formula C21H25Cl3O8 Melting Point N/A
MSDS N/A Flash Point 192.1ºC

 Names

Name 3α,4β,15-tris(chloroacetoxy)scirpene

 Chemical & Physical Properties

Density 1.46g/cm3
Boiling Point 574.5ºC at 760 mmHg
Molecular Formula C21H25Cl3O8
Molecular Weight 511.77700
Flash Point 192.1ºC
Exact Mass 510.06200
PSA 100.66000
LogP 2.35240
Index of Refraction 1.566
InChIKey HEEALAHSJWSRCQ-UHFFFAOYSA-N
SMILES CC1=CC2OC3C(OC(=O)CCl)C(OC(=O)CCl)C(C)(C2(COC(=O)CCl)CC1)C31CO1
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