CS-0907400
tert-Butyl 4-nitroisoindoline-2-carboxylate
Manufacturer: ChemScene
CAS Number: 1194375-32-0
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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
C₁₃H₁₆N₂O₄
Molecular Weight
264.28
Synonyms
None
SMILES
O=C(N1CC2=C(C([N+]([O-])=O)=CC=C2)C1)OC(C)(C)C
Tpsa
72.68
Logp
2.8455
H Acceptors
4
H Donors
0
Rotatable Bonds
1
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₁₃H₁₆N₂O₄
Molecular Weight: 264.28
Synonyms: None
SMILES: O=C(N1CC2=C(C([N+]([O-])=O)=CC=C2)C1)OC(C)(C)C
Tpsa: 72.68
Logp: 2.8455
H Acceptors: 4
H Donors: 0
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:
C₁₃H₁₆N₂O₄
Molecular Weight:
264.28
Synonyms:
None
SMILES:
O=C(N1CC2=C(C([N+]([O-])=O)=CC=C2)C1)OC(C)(C)C
Tpsa:
72.68
Logp:
2.8455
H Acceptors:
4
H Donors:
0
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: C₁₁H₁₂F₃N
Molecular Weight: 215.21
Synonyms: None
SMILES: FC(C1N(CC2=CC=CC=C2)CC1)(F)F
Tpsa: 3.24
Logp: 2.8232
H Acceptors: 1
H Donors: 0
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:
C₁₁H₁₂F₃N
Molecular Weight:
215.21
Synonyms:
None
SMILES:
FC(C1N(CC2=CC=CC=C2)CC1)(F)F
Tpsa:
3.24
Logp:
2.8232
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₆N₂O₃
Molecular Weight: 224.26
Synonyms: None
SMILES: O=C(C1=CN(C2CCOCC2)N=C1)OCC
Tpsa: 53.35
Logp: 1.4113
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₆N₂O₃
Molecular Weight:
224.26
Synonyms:
None
SMILES:
O=C(C1=CN(C2CCOCC2)N=C1)OCC
Tpsa:
53.35
Logp:
1.4113
H Acceptors:
5
H Donors:
0
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: C₂₀H₂₈N₂O₄
Molecular Weight: 360.45
Synonyms: None
SMILES: O=C(N1CC2(CN(CC3=CC=CC=C3)CC2C(OC)=O)C1)OC(C)(C)C
Tpsa: 59.08
Logp: 2.5285
H Acceptors: 5
H Donors: 0
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:
C₂₀H₂₈N₂O₄
Molecular Weight:
360.45
Synonyms:
None
SMILES:
O=C(N1CC2(CN(CC3=CC=CC=C3)CC2C(OC)=O)C1)OC(C)(C)C
Tpsa:
59.08
Logp:
2.5285
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3