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Retrorsine

Retrorsine structure

CAS No:
480-54-6
Formula:
C18H25NO6
Chemical Name:
Retrorsine
Synonyms:
[1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione,3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl-,(3Z,5R,6S,14aR,14bR)-;Retrorsine;Senecionan-11,16-dione,12,18-dihydroxy-;(3Z,5R,6S,14aR,14bR)-3-Ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione;Retrorsin;β-Longilobine;[1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione,3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl-,[5R-(3Z,5R*,6S*,14aR*,14bR*)]-;NSC 107659;1416-49-5
Categories:
Analytical Chemistry > Standard

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Retrorsine Basic Attributes

Molecular Weight：

351.39

Exact Mass：

351.39

Characteristics

PSA：

96.30000

XLogP3：

-0.14

Density：

1.3±0.1 g/cm3

Melting Point：

212 °C

Boiling Point：

583.2±50.0 °C at 760 mmHg

Flash Point：

306.5±30.1 °C

Refractive Index：

1.590

Water Solubility：

Soluble in chloroform; slightly soluble in acetone, ethanol, water

Storage Conditions：

-20°C

Vapor Pressure：

1.9X10-14 mm Hg @ 25 °C /Estimated/

Specific rotation：

D18 -17.6° (c = 1.99 in ethanol)

Safety Information

Packing level：

Hazard category：

6.1(a)

Transport codes：

1544

wgk germany：

hazard class code：

safety instructions：

22-36/37/39-45

RTECS Number：

VH7525000

Marks：

Stability/Shelf Life：

Stability: stable at room temperature in closed containers: best stored under nitrogen -15 °C.

Precautionary statement(s)：

P264-P301 + P310

Hazard Statements：

H300

Computed Properties

Molecular Weight:351.4
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:351.16818752
Monoisotopic Mass:351.16818752
Topological Polar Surface Area:96.3
Heavy Atom Count:25
Complexity:627
Defined Atom Stereocenter Count:4
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Shaanxi Dideu Medichem Co. Ltd Contact Supplier

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RETRORSINE

CAS No.: 480-54-6

Grade: Industrial Grade

Content: 99%

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