CS-0822974
Sodium cyclobutane-1,1-dicarboxylate
Manufacturer: ChemScene
CAS Number: 100476-94-6
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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
C₆H₆Na₂O₄
Molecular Weight
188.09
Synonyms
None
SMILES
O=C(O[Na])C1(C(O[Na])=O)CCC1
Tpsa
52.6
Logp
-0.5899
H Acceptors
4
H Donors
0
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: C₆H₆Na₂O₄
Molecular Weight: 188.09
Synonyms: None
SMILES: O=C(O[Na])C1(C(O[Na])=O)CCC1
Tpsa: 52.6
Logp: -0.5899
H Acceptors: 4
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:
C₆H₆Na₂O₄
Molecular Weight:
188.09
Synonyms:
None
SMILES:
O=C(O[Na])C1(C(O[Na])=O)CCC1
Tpsa:
52.6
Logp:
-0.5899
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD19443817
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₁₇N₃O₄
Molecular Weight: 375.38
Synonyms: Demethyl Tadalafil
SMILES: O=C1NCC(N([C@@H]1C2)[C@H](C3=CC=C(OCO4)C4=C3)C5=C2C6=C(N5)C=CC=C6)=O
Tpsa: 83.66
Logp: 1.8691
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD19443817
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₁₇N₃O₄
Molecular Weight:
375.38
Synonyms:
Demethyl Tadalafil
SMILES:
O=C1NCC(N([C@@H]1C2)[C@H](C3=CC=C(OCO4)C4=C3)C5=C2C6=C(N5)C=CC=C6)=O
Tpsa:
83.66
Logp:
1.8691
H Acceptors:
4
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: C₂₄H₂₃FN₄O₄
Molecular Weight: 450.46
Synonyms: None
SMILES: O=C1C2=CC=CC=C2C(C(O)C3=CC=C(F)C(C(N4CCN(C(C5CC5)=O)CC4)=O)=C3)=NN1
Tpsa: 106.6
Logp: 1.8383
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₃FN₄O₄
Molecular Weight:
450.46
Synonyms:
None
SMILES:
O=C1C2=CC=CC=C2C(C(O)C3=CC=C(F)C(C(N4CCN(C(C5CC5)=O)CC4)=O)=C3)=NN1
Tpsa:
106.6
Logp:
1.8383
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₃ClFNO₃
Molecular Weight: 297.71
Synonyms: None
SMILES: ClC1=C(F)C=C2C(N=CC(C(OCC)=O)=C2OCC)=C1
Tpsa: 48.42
Logp: 3.6027
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₃ClFNO₃
Molecular Weight:
297.71
Synonyms:
None
SMILES:
ClC1=C(F)C=C2C(N=CC(C(OCC)=O)=C2OCC)=C1
Tpsa:
48.42
Logp:
3.6027
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4