CS-0647519
2-(1,1-Dimethylethyl) 4-methyl (2S,4S,5S)-5-methyl-2,4-pyrrolidinedicarboxylate
Manufacturer: ChemScene
CAS Number: 862079-69-4
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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
C₁₂H₂₁NO₄
Molecular Weight
243.30
Synonyms
None
SMILES
O=C([C@H]1N[C@@H](C)[C@@H](C(OC)=O)C1)OC(C)(C)C
Tpsa
64.63
Logp
0.8677
H Acceptors
5
H Donors
1
Rotatable Bonds
2
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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: C₁₂H₂₁NO₄
Molecular Weight: 243.30
Synonyms: None
SMILES: O=C([C@H]1N[C@@H](C)[C@@H](C(OC)=O)C1)OC(C)(C)C
Tpsa: 64.63
Logp: 0.8677
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:
C₁₂H₂₁NO₄
Molecular Weight:
243.30
Synonyms:
None
SMILES:
O=C([C@H]1N[C@@H](C)[C@@H](C(OC)=O)C1)OC(C)(C)C
Tpsa:
64.63
Logp:
0.8677
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: C₈H₄BrFN₂O
Molecular Weight: 243.03
Synonyms: None
SMILES: FC1=CC(C2=NN=C(Br)O2)=CC=C1
Tpsa: 38.92
Logp: 2.6382
H Acceptors: 3
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:
C₈H₄BrFN₂O
Molecular Weight:
243.03
Synonyms:
None
SMILES:
FC1=CC(C2=NN=C(Br)O2)=CC=C1
Tpsa:
38.92
Logp:
2.6382
H Acceptors:
3
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: C₁₂H₁₀BrNO₄
Molecular Weight: 312.12
Synonyms: None
SMILES: O=C(CN1C(C(C2=CC(Br)=CC=C21)=O)=O)OCC
Tpsa: 63.68
Logp: 1.5415
H Acceptors: 4
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:
C₁₂H₁₀BrNO₄
Molecular Weight:
312.12
Synonyms:
None
SMILES:
O=C(CN1C(C(C2=CC(Br)=CC=C21)=O)=O)OCC
Tpsa:
63.68
Logp:
1.5415
H Acceptors:
4
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: C₃F₃IN₂O
Molecular Weight: 263.94
Synonyms: None
SMILES: FC(C1=NN=C(I)O1)(F)F
Tpsa: 38.92
Logp: 1.693
H Acceptors: 3
H Donors: 0
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:
C₃F₃IN₂O
Molecular Weight:
263.94
Synonyms:
None
SMILES:
FC(C1=NN=C(I)O1)(F)F
Tpsa:
38.92
Logp:
1.693
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0