CS-0053293

(3R,5S)-5-O-DMT-3-pyrrolidinol

Manufacturer: ChemScene

CAS Number: 151953-64-9

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Purity

98%

MDL No

MFCD29918292

Storage

4°C, protect from light

Shipping

Room temperature in continental US; may vary elsewhere.

Molecular Formula

C₂₆H₂₉NO₄

Molecular Weight

419.51

Synonyms

None

SMILES

COC1=CC=C(C=C1)C(OC[C@@H]1C[C@@H](O)CN1)(C1=CC=CC=C1)C1=CC=C(OC)C=C1

Tpsa

59.95

Logp

3.7351

H Acceptors

5

H Donors

2

Rotatable Bonds

8

SAFETY INFORMATION

Pictograms

GHS07

Signal Word

Warning

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

H315-H319-H335

Precautionary Statements

P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Img

ChemScene

CS-0053293

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Purity:
98%

MDL No:
MFCD29918292

Storage:
4°C, protect from light

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₂₆H₂₉NO₄

Molecular Weight:
419.51

Synonyms:
None

SMILES:
COC1=CC=C(C=C1)C(OC[C@@H]1C[C@@H](O)CN1)(C1=CC=CC=C1)C1=CC=C(OC)C=C1

Tpsa:
59.95

Logp:
3.7351

H Acceptors:
5

H Donors:
2

Rotatable Bonds:
8

Img

ChemScene

CS-0053294

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Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₆H₁₂N₂O

Molecular Weight:
128.17

Synonyms:
(3R,5R)-3,5-Dimethyl-2-piperazinone

SMILES:
C[C@@H]1CNC(=O)[C@@H](C)N1

Tpsa:
41.13

Logp:
-0.5172

H Acceptors:
2

H Donors:
2

Rotatable Bonds:
0

Img

ChemScene

CS-0053295

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Purity:
95%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₁H₁₉NO₄

Molecular Weight:
229.27

Synonyms:
(3R,5R)-5-Methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinecarboxylic acid

SMILES:
C[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)C(O)=O

Tpsa:
66.84

Logp:
1.7165

H Acceptors:
3

H Donors:
1

Rotatable Bonds:
1

Img

ChemScene

CS-0053296

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Purity:
97% mix TBC as stabilizer

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₂₅H₂₈O₇

Molecular Weight:
440.49

Synonyms:
1,2-Di-O-acetyl-3-O-benzyl-4-[(benzyloxy)methyl]-5,6-dideoxy-L-lyxo-hex-5-enofuranose

SMILES:
CC(=O)OC1O[C@@](COCC2=CC=CC=C2)(C=C)[C@@H](OCC2=CC=CC=C2)[C@H]1OC(C)=O

Tpsa:
80.29

Logp:
3.5645

H Acceptors:
7

H Donors:
0

Rotatable Bonds:
10