CAS 112966-96-8|Domitroban

Introduction：Basic information about CAS 112966-96-8|Domitroban, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Synonyms

Common Name	Domitroban
CAS Number	112966-96-8	Molecular Weight	377.49800
Density	1.26g/cm3	Boiling Point	563.4ºC at 760mmHg
Molecular Formula	C₂₀H₂₇NO₄S	Melting Point	/
MSDS	/	Flash Point	294.5ºC

Names

Name	(5Z)-7-{(1R,2S,3S,4S)-3-[(Phenylsulfonyl)amino]bicyclo[2.2.1]hept -2-yl}-5-heptenoic acid
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.26g/cm3
Boiling Point	563.4ºC at 760mmHg
Molecular Formula	C₂₀H₂₇NO₄S
Molecular Weight	377.49800
Flash Point	294.5ºC
Exact Mass	377.16600
PSA	91.85000
LogP	5.05250
Vapour Pressure	1.58E-13mmHg at 25°C
Index of Refraction	1.594
InChIKey	PWTCIBWRMQFJBC-ZEMKZVSASA-N
SMILES	O=C(O)CCCC=CCC1C2CCC(C2)C1NS(=O)(=O)c1ccccc1

Synonyms

(+)-(5S,10S)-12-hydroxypodocarpa-8,11,13-triene

podocarpatrien-(C)-ol-(12)

(1R,2S,3S,4S)-(5Z)-7-(3-((Phenylsulfonyl)amino)bicyclo<2.2.1>hept-2-yl)hept-5-enoic Acid

(+)5(Z)-7-[3-endo-phenylsulfonylamino[2.2.1]-bicyclohept-2-exo-yl]-heptenoic acid

(+)-(5Z)-7-(3-endo-((Phenylsulfonyl)amino)bicyclo<2.2.1>hept-2-exo-yl)heptenoic Acid

(4aS)-6-Hydroxy-1.1.4ar-trimethyl-(10atH)-1.2.3.4.4a.9.10.10a-octahydro-phenanthren

trans-6-Hydroxy-1,1,12-trimethyl-1,2,3,4,9,10,11,12-octahydro-phenanthren

12-hydroxypodocarpa-8,11,13-triene

3-Phenanthrenol,4b,5,6,7,8,8a,9,10-octahydro-4b,8,8-trimethyl-,(4bS-trans)

(4bS,8aS)-4b,8,8-trimethyl-5,6,7,8a,9,10-hexahydrophenanthren-3-ol

podocarpa-8,11,13-trien-12-ol

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