Neolinine

Catalog Number	ACM112515374
CAS Number	112515-37-4
Structure
Synonyms	(1alpha,6alpha,14alpha,16beta)-20-Ethyl-4-(hydroxymethyl)-6,16-dimethoxyaconitane-1,8,14-triol
Molecular Weight	423.5
InChI	InChI=1S/C23H37NO6/c1-4-24-9-21(10-25)6-5-14(26)23-12-7-11-13(29-2)8-22(28,15(12)17(11)27)16(20(23)24)18(30-3)19(21)23/h11-20,25-28H,4-10H2,1-3H3
InChI Key	RQCXQGUVPFYJCE-UHFFFAOYSA-N
Purity	95%+
Complexity	737
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Exact Mass	423.2620879
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	4
Monoisotopic Mass	423.2620879
PhysicalState	Powder
Rotatable Bond Count	4
Topological Polar Surface Area	103 Ų

Custom Q&A

What is the product name of the chemical compound with CAS number 112515-37-4?

Neolinine

What are some synonyms of Neolinine?

(1alpha,6alpha,14alpha,16beta)-20-Ethyl-4-(hydroxymethyl)-6,16-dimethoxyaconitane-1,8,14-triol; Aconitane-1,8,14-triol, 20-ethyl-4-(hydroxymethyl)-6,16-dimethoxy-, (1α,6α,14α,16β)-

What is the molecular formula of Neolinine?

C23H37NO6

What is the molecular weight of Neolinine?

423.55

What is the predicted boiling point of Neolinine?

587.2±50.0 °C

What is the predicted density of Neolinine?

1.37±0.1 g/cm3

What is the predicted pKa value of Neolinine?

13.32±0.70

What is the predicted boiling point range of Neolinine?

537.2 °C - 637.2 °C

What is the predicted density range of Neolinine?

1.27 g/cm3 - 1.47 g/cm3

What is the predicted pKa value range of Neolinine?

12.62 - 14.02

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