CS-0443369
Tert-butyl 1-oxohexahydro-1H-3a,7-epoxypyrrolo[3,4-c]azepine-5(4H)-carboxylate
Manufacturer: ChemScene
CAS Number: 1251006-48-0
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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
C₁₃H₂₀N₂O₄
Molecular Weight
268.31
Synonyms
4-Oxo-11-Oxa-3,9-Diaza-Tricyclo[5.3.1.01,5]Undecane-9-Carboxylic Acid Tert-Butyl Ester(WX115386)
SMILES
CC(C)(OC(N1CC2CC3C(NCC3(O2)C1)=O)=O)C
Tpsa
67.87
Logp
0.5108
H Acceptors
4
H Donors
1
Rotatable Bonds
0
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: C₁₃H₂₀N₂O₄
Molecular Weight: 268.31
Synonyms: 4-Oxo-11-Oxa-3,9-Diaza-Tricyclo[5.3.1.01,5]Undecane-9-Carboxylic Acid Tert-Butyl Ester(WX115386)
SMILES: CC(C)(OC(N1CC2CC3C(NCC3(O2)C1)=O)=O)C
Tpsa: 67.87
Logp: 0.5108
H Acceptors: 4
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:
C₁₃H₂₀N₂O₄
Molecular Weight:
268.31
Synonyms:
4-Oxo-11-Oxa-3,9-Diaza-Tricyclo[5.3.1.01,5]Undecane-9-Carboxylic Acid Tert-Butyl Ester(WX115386)
SMILES:
CC(C)(OC(N1CC2CC3C(NCC3(O2)C1)=O)=O)C
Tpsa:
67.87
Logp:
0.5108
H Acceptors:
4
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: C₁₉H₂₇N₃O₄
Molecular Weight: 361.44
Synonyms: 3-Benzyl 9-Tert-Butyl 3,7,9-Triazabicyclo[3.3.1]Nonane-3,9-Dicarboxylate(WX120114)
SMILES: CC(C)(C)OC(=O)N1C2CNCC1CN(C2)C(=O)OCC3=CC=CC=C3
Tpsa: 71.11
Logp: 2.2163
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:
C₁₉H₂₇N₃O₄
Molecular Weight:
361.44
Synonyms:
3-Benzyl 9-Tert-Butyl 3,7,9-Triazabicyclo[3.3.1]Nonane-3,9-Dicarboxylate(WX120114)
SMILES:
CC(C)(C)OC(=O)N1C2CNCC1CN(C2)C(=O)OCC3=CC=CC=C3
Tpsa:
71.11
Logp:
2.2163
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: C₁₃H₂₄N₂O₂
Molecular Weight: 240.34
Synonyms: Racemic-(3aR,4S,7aS)-tert-butyl 4-aminohexahydro-1H-isoindole-2(3H)-carboxylate(WX110057)
SMILES: CC(C)(C)OC(=O)N1C[C@H]2CCC[C@@H]([C@H]2C1)N
Tpsa: 55.56
Logp: 1.9807
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:
C₁₃H₂₄N₂O₂
Molecular Weight:
240.34
Synonyms:
Racemic-(3aR,4S,7aS)-tert-butyl 4-aminohexahydro-1H-isoindole-2(3H)-carboxylate(WX110057)
SMILES:
CC(C)(C)OC(=O)N1C[C@H]2CCC[C@@H]([C@H]2C1)N
Tpsa:
55.56
Logp:
1.9807
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₈FN₃
Molecular Weight: 129.14
Synonyms: 1-(2-Fluoro-ethyl)-1H-pyrazol-3-ylamine
SMILES: FCCN1N=C(N)C=C1
Tpsa: 43.84
Logp: 0.4348
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₈FN₃
Molecular Weight:
129.14
Synonyms:
1-(2-Fluoro-ethyl)-1H-pyrazol-3-ylamine
SMILES:
FCCN1N=C(N)C=C1
Tpsa:
43.84
Logp:
0.4348
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2