CS-0781699
rel-(2R,4R)-1-(tert-Butoxycarbonyl)-4-(difluoromethyl)-4-hydroxypiperidine-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2890223-15-9
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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
C₁₂H₁₉F₂NO₅
Molecular Weight
295.28
Synonyms
None
SMILES
O=C(N1[C@@H](C(O)=O)C[C@@](O)(C(F)F)CC1)OC(C)(C)C
Tpsa
87.07
Logp
1.4667
H Acceptors
4
H Donors
2
Rotatable Bonds
2
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₉F₂NO₅
Molecular Weight: 295.28
Synonyms: None
SMILES: O=C(N1[C@@H](C(O)=O)C[C@@](O)(C(F)F)CC1)OC(C)(C)C
Tpsa: 87.07
Logp: 1.4667
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₉F₂NO₅
Molecular Weight:
295.28
Synonyms:
None
SMILES:
O=C(N1[C@@H](C(O)=O)C[C@@](O)(C(F)F)CC1)OC(C)(C)C
Tpsa:
87.07
Logp:
1.4667
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₂₆F₄N₈O₂
Molecular Weight: 546.52
Synonyms: KTX-1001
SMILES: FC(C=C(C(F)=C1)OC)=C1C2=NC=C(N3C[C@](N)(CCC3)[C@H](O)C(F)F)C(CN4C5=NC=NC(N)=C5N=C4)=C2
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₂₆F₄N₈O₂
Molecular Weight:
546.52
Synonyms:
KTX-1001
SMILES:
FC(C=C(C(F)=C1)OC)=C1C2=NC=C(N3C[C@](N)(CCC3)[C@H](O)C(F)F)C(CN4C5=NC=NC(N)=C5N=C4)=C2
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 97%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₀N₂O₂S
Molecular Weight: 198.24
Synonyms: None
SMILES: NC1=CC=C(S(=O)(C2CC2)=O)N=C1
Tpsa: 73.05
Logp: 0.5999
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₀N₂O₂S
Molecular Weight:
198.24
Synonyms:
None
SMILES:
NC1=CC=C(S(=O)(C2CC2)=O)N=C1
Tpsa:
73.05
Logp:
0.5999
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₈N₂O
Molecular Weight: 160.17
Synonyms: None
SMILES: OC1=CC=C(C2=CN=CN2)C=C1
Tpsa: 48.91
Logp: 1.7823
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₈N₂O
Molecular Weight:
160.17
Synonyms:
None
SMILES:
OC1=CC=C(C2=CN=CN2)C=C1
Tpsa:
48.91
Logp:
1.7823
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1