CS-0876771
Rel-(2R,2'S)-2,2'-bipyrrolidine sesquioxalate
Manufacturer: ChemScene
CAS Number: 1580593-10-7
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Purity
97%
MDL No
MFCD15144819
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₂H₃₈N₄O₁₂
Molecular Weight
550.56
Synonyms
None
SMILES
C1C[C@@H](NC1)[C@@H]2CCCN2.C1C[C@@H](NC1)[C@@H]2CCCN2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O
Tpsa
271.92
Logp
-1.5524
H Acceptors
10
H Donors
10
Rotatable Bonds
2
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: 97%
MDL No: MFCD15144819
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₃₈N₄O₁₂
Molecular Weight: 550.56
Synonyms: None
SMILES: C1C[C@@H](NC1)[C@@H]2CCCN2.C1C[C@@H](NC1)[C@@H]2CCCN2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O
Tpsa: 271.92
Logp: -1.5524
H Acceptors: 10
H Donors: 10
Rotatable Bonds: 2
Purity:
97%
MDL No:
MFCD15144819
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₃₈N₄O₁₂
Molecular Weight:
550.56
Synonyms:
None
SMILES:
C1C[C@@H](NC1)[C@@H]2CCCN2.C1C[C@@H](NC1)[C@@H]2CCCN2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O
Tpsa:
271.92
Logp:
-1.5524
H Acceptors:
10
H Donors:
10
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: C₂₅H₂₈O₈S
Molecular Weight: 488.55
Synonyms: None
SMILES: CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)SC2=CC=CC=C2)OC(=O)C)OCC3=CC=CC=C3)OC(=O)C
Tpsa: 97.36
Logp: 3.5155
H Acceptors: 9
H Donors: 0
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:
C₂₅H₂₈O₈S
Molecular Weight:
488.55
Synonyms:
None
SMILES:
CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)SC2=CC=CC=C2)OC(=O)C)OCC3=CC=CC=C3)OC(=O)C
Tpsa:
97.36
Logp:
3.5155
H Acceptors:
9
H Donors:
0
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: C₇H₈N₄O₂
Molecular Weight: 180.16
Synonyms: None
SMILES: CN1C=NC2=C1N(C(=O)NC2=O)C
Tpsa: 72.68
Logp: -1.0397
H Acceptors: 5
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:
C₇H₈N₄O₂
Molecular Weight:
180.16
Synonyms:
None
SMILES:
CN1C=NC2=C1N(C(=O)NC2=O)C
Tpsa:
72.68
Logp:
-1.0397
H Acceptors:
5
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: C₅H₂F₈
Molecular Weight: 214.06
Synonyms: None
SMILES: F[C@@H]1[C@@H](F)C(F)(F)C(F)(F)C1(F)F
Tpsa: 0
Logp: 2.5821
H Acceptors: 0
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:
C₅H₂F₈
Molecular Weight:
214.06
Synonyms:
None
SMILES:
F[C@@H]1[C@@H](F)C(F)(F)C(F)(F)C1(F)F
Tpsa:
0
Logp:
2.5821
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
0