(3R)-(−)-3-(1-Methyl-1H-indol-3-yl)butyraldehyde - 98%, high purity , CAS No.405873-05-4

Item Number

R473283

Grouped product items
SKU	Size	Availability	Price	Qty
R473283-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,219.90	+-

Basic Description

Synonyms	(3R)-3-(1-methylindol-3-yl)butanal \| OQWWHYBHQFZHLP-SNVBAGLBSA-N \| (3R)-(-)-3-(1-Methyl-1H-indol-3-yl)butyraldehyde \| DTXSID70432531 \| SCHEMBL6655804 \| (R)-3-(1-methyl-1h-indol-3-yl)butanal \| (R)-3-(1-methyl-1h-indol-3-yl)-butanal \| 1H-Indole-3-propanal,b
Specifications & Purity	≥98%
Product Description	Description (3R)-(−)-3-(1-Methyl-1H-indol-3-yl)butyraldehyde can be used as a substrate in the synthesis of 2-alkyl cyclohexanone intermediates, applicable in the preparation of tricyclic steroid precursors.

Names and Identifiers

IUPAC Name	(3R)-3-(1-methylindol-3-yl)butanal
INCHI	InChI=1S/C13H15NO/c1-10(7-8-15)12-9-14(2)13-6-4-3-5-11(12)13/h3-6,8-10H,7H2,1-2H3/t10-/m1/s1
InChi Key	OQWWHYBHQFZHLP-SNVBAGLBSA-N
Canonical SMILES	CC(CC=O)C1=CN(C2=CC=CC=C21)C
Isomeric SMILES	C[C@H](CC=O)C1=CN(C2=CC=CC=C21)C
WGK Germany	3
PubChem CID	9899133
UN Number	2811
Packing Group	III
Molecular Weight	201.26

Chemical and Physical Properties

Melt Point(°C)	55.5-59.5 °C
Molecular Weight	201.260 g/mol
XLogP3	2.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	201.115 Da
Monoisotopic Mass	201.115 Da
Topological Polar Surface Area	22.000 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	229.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Safety and Hazards(GHS)

Pictogram(s)	GHS06, GHS07
Signal	Danger
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation H301:Toxic if swallowed
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P270:Do not eat, drink or smoke when using this product. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P330:Rinse mouth. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P301+P316:IF SWALLOWED: Get emergency medical help immediately. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell.
WGK Germany	3
Class	6.1
RIDADR	UN28116.1/PGIII

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Basic Description