CS-0112343
rel-Methyl (3R,4R)-4-amino-1-(cyclopropylmethyl)piperidine-3-carboxylate
Manufacturer: ChemScene
CAS Number: 2178052-81-6
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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
C₁₁H₂₀N₂O₂
Molecular Weight
212.29
Synonyms
None
SMILES
O=C([C@@H]1CN(CC2CC2)CC[C@H]1N)OC
Tpsa
55.56
Logp
0.2186
H Acceptors
4
H Donors
1
Rotatable Bonds
3
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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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₂₀N₂O₂
Molecular Weight: 212.29
Synonyms: None
SMILES: O=C([C@@H]1CN(CC2CC2)CC[C@H]1N)OC
Tpsa: 55.56
Logp: 0.2186
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₂₀N₂O₂
Molecular Weight:
212.29
Synonyms:
None
SMILES:
O=C([C@@H]1CN(CC2CC2)CC[C@H]1N)OC
Tpsa:
55.56
Logp:
0.2186
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD17000029
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₃NO₂
Molecular Weight: 167.21
Synonyms: None
SMILES: OC1=CC=C(OC(C)(C)C)N=C1
Tpsa: 42.35
Logp: 1.9645
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD17000029
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₃NO₂
Molecular Weight:
167.21
Synonyms:
None
SMILES:
OC1=CC=C(OC(C)(C)C)N=C1
Tpsa:
42.35
Logp:
1.9645
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD08063721
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₀H₂₉F₂NO₉
Molecular Weight: 585.55
Synonyms: Ezetimibe glucuronide; Ezetimibe β-D-glucuronide
SMILES: O[C@H]([C@H]([C@@H]([C@@H](C(O)=O)O1)O)O)[C@@H]1OC2=CC=C([C@H]([C@H]3CC[C@@H](C4=CC=C(F)C=C4)O)N(C5=CC=C(F)C=C5)C3=O)C=C2
Tpsa: 156.99
Logp: 2.4537
H Acceptors: 8
H Donors: 5
Rotatable Bonds: 9
Purity:
98%
MDL No:
MFCD08063721
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₀H₂₉F₂NO₉
Molecular Weight:
585.55
Synonyms:
Ezetimibe glucuronide; Ezetimibe β-D-glucuronide
SMILES:
O[C@H]([C@H]([C@@H]([C@@H](C(O)=O)O1)O)O)[C@@H]1OC2=CC=C([C@H]([C@H]3CC[C@@H](C4=CC=C(F)C=C4)O)N(C5=CC=C(F)C=C5)C3=O)C=C2
Tpsa:
156.99
Logp:
2.4537
H Acceptors:
8
H Donors:
5
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₅FN₂O₂
Molecular Weight: 250.27
Synonyms: None
SMILES: O=C1NC2=C(C(O)=CC=C2F)C3(CCCCC3)N1
Tpsa: 61.36
Logp: 2.8258
H Acceptors: 2
H Donors: 3
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₅FN₂O₂
Molecular Weight:
250.27
Synonyms:
None
SMILES:
O=C1NC2=C(C(O)=CC=C2F)C3(CCCCC3)N1
Tpsa:
61.36
Logp:
2.8258
H Acceptors:
2
H Donors:
3
Rotatable Bonds:
0