CS-0896794
tert-Butyl 1-cyano-5-(hydroxymethyl)-3-azabicyclo[3.1.1]heptane-3-carboxylate
Manufacturer: ChemScene
CAS Number: 2932439-68-2
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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
C₁₃H₂₀N₂O₃
Molecular Weight
252.31
Synonyms
None
SMILES
O=C(N1CC(C2)(C#N)CC2(CO)C1)OC(C)(C)C
Tpsa
73.56
Logp
1.51958
H Acceptors
4
H Donors
1
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₀N₂O₃
Molecular Weight: 252.31
Synonyms: None
SMILES: O=C(N1CC(C2)(C#N)CC2(CO)C1)OC(C)(C)C
Tpsa: 73.56
Logp: 1.51958
H Acceptors: 4
H Donors: 1
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:
C₁₃H₂₀N₂O₃
Molecular Weight:
252.31
Synonyms:
None
SMILES:
O=C(N1CC(C2)(C#N)CC2(CO)C1)OC(C)(C)C
Tpsa:
73.56
Logp:
1.51958
H Acceptors:
4
H Donors:
1
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: C₁₇H₂₉NO₅
Molecular Weight: 327.42
Synonyms: None
SMILES: O=C(C1(C2)CN(C(OC(C)(C)C)=O)CC2(CO)C1)OC(C)(C)C
Tpsa: 76.07
Logp: 2.3377
H Acceptors: 5
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:
C₁₇H₂₉NO₅
Molecular Weight:
327.42
Synonyms:
None
SMILES:
O=C(C1(C2)CN(C(OC(C)(C)C)=O)CC2(CO)C1)OC(C)(C)C
Tpsa:
76.07
Logp:
2.3377
H Acceptors:
5
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: C₁₂H₂₀N₂O₂
Molecular Weight: 224.30
Synonyms: None
SMILES: O=C(N(CC=CC1)C21CNC2)OC(C)(C)C
Tpsa: 41.57
Logp: 1.5254
H Acceptors: 3
H Donors: 1
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:
C₁₂H₂₀N₂O₂
Molecular Weight:
224.30
Synonyms:
None
SMILES:
O=C(N(CC=CC1)C21CNC2)OC(C)(C)C
Tpsa:
41.57
Logp:
1.5254
H Acceptors:
3
H Donors:
1
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: C₅H₆FN₃
Molecular Weight: 127.12
Synonyms: None
SMILES: NNC1=CC=CN=C1F
Tpsa: 50.94
Logp: 0.5063
H Acceptors: 3
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:
C₅H₆FN₃
Molecular Weight:
127.12
Synonyms:
None
SMILES:
NNC1=CC=CN=C1F
Tpsa:
50.94
Logp:
0.5063
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1