CS-W001712
tert-Butyl (4S,5S)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)piperidine-1-carboxylate racemic
Manufacturer: ChemScene
CAS Number: 1881275-72-4
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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
C₁₁H₁₉F₂NO₄
Molecular Weight
267.27
Synonyms
tert-butyl Trans-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)piperidine-1-carboxylate racemate
SMILES
OC[C@@H]1CN(CC([C@H]1O)(F)F)C(=O)OC(C)(C)C
Tpsa
70
Logp
0.8418
H Acceptors
4
H Donors
2
Rotatable Bonds
1
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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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: C₁₁H₁₉F₂NO₄
Molecular Weight: 267.27
Synonyms: tert-butyl Trans-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)piperidine-1-carboxylate racemate
SMILES: OC[C@@H]1CN(CC([C@H]1O)(F)F)C(=O)OC(C)(C)C
Tpsa: 70
Logp: 0.8418
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₉F₂NO₄
Molecular Weight:
267.27
Synonyms:
tert-butyl Trans-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)piperidine-1-carboxylate racemate
SMILES:
OC[C@@H]1CN(CC([C@H]1O)(F)F)C(=O)OC(C)(C)C
Tpsa:
70
Logp:
0.8418
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD28975647
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₉F₂NO₅S
Molecular Weight: 315.33
Synonyms: None
SMILES: O=C(N1CCC(C(C1)OS(=O)(=O)C)(F)F)OC(C)(C)C
Tpsa: 72.91
Logp: 1.6073
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD28975647
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₉F₂NO₅S
Molecular Weight:
315.33
Synonyms:
None
SMILES:
O=C(N1CCC(C(C1)OS(=O)(=O)C)(F)F)OC(C)(C)C
Tpsa:
72.91
Logp:
1.6073
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Store at room temperature, keep dry and cool
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₁Br₂N
Molecular Weight: 329.03
Synonyms: 1-benzyl-3-bromopyridin-1-ium bromide
SMILES: Brc1ccc[n+](c1)Cc1ccccc1.[Br-]
Tpsa: 3.88
Logp: -0.2111
H Acceptors: 0
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Store at room temperature, keep dry and cool
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₁Br₂N
Molecular Weight:
329.03
Synonyms:
1-benzyl-3-bromopyridin-1-ium bromide
SMILES:
Brc1ccc[n+](c1)Cc1ccccc1.[Br-]
Tpsa:
3.88
Logp:
-0.2111
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD28016264
Storage: Store at room temperature, keep dry and cool
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₁Br₂N
Molecular Weight: 329.03
Synonyms: 1-Benzyl-4-bromopyridinium bromide
SMILES: BrC1=CC=[N+](C=C1)CC2=CC=CC=C2.[Br-]
Tpsa: 3.88
Logp: -0.2111
H Acceptors: 0
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD28016264
Storage:
Store at room temperature, keep dry and cool
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₁Br₂N
Molecular Weight:
329.03
Synonyms:
1-Benzyl-4-bromopyridinium bromide
SMILES:
BrC1=CC=[N+](C=C1)CC2=CC=CC=C2.[Br-]
Tpsa:
3.88
Logp:
-0.2111
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
2