CS-1102555
1-(1,1-Dimethylethyl) pentacyclo[4.2.0.02,5.03,8.04,7]octane-1,4-dicarboxylate
Manufacturer: ChemScene
CAS Number: 2345705-37-3
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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
C₁₄H₁₆O₄
Molecular Weight
248.27
Synonyms
None
SMILES
O=C(C12C3C4C5(C(O)=O)C3C1C5C24)OC(C)(C)C
Tpsa
63.6
Logp
1.1507
H Acceptors
3
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: C₁₄H₁₆O₄
Molecular Weight: 248.27
Synonyms: None
SMILES: O=C(C12C3C4C5(C(O)=O)C3C1C5C24)OC(C)(C)C
Tpsa: 63.6
Logp: 1.1507
H Acceptors: 3
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:
C₁₄H₁₆O₄
Molecular Weight:
248.27
Synonyms:
None
SMILES:
O=C(C12C3C4C5(C(O)=O)C3C1C5C24)OC(C)(C)C
Tpsa:
63.6
Logp:
1.1507
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₅D₃N₂O₂
Molecular Weight: 155.17
Synonyms: None
SMILES: O=C(O)C1=C([2H])C(N)=C([2H])C([2H])=C1N
Tpsa: 89.34
Logp: 0.5492
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₅D₃N₂O₂
Molecular Weight:
155.17
Synonyms:
None
SMILES:
O=C(O)C1=C([2H])C(N)=C([2H])C([2H])=C1N
Tpsa:
89.34
Logp:
0.5492
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Store at room temperature, keep dry and cool
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₁ClF₃NO
Molecular Weight: 205.61
Synonyms: None
SMILES: FC(F)([C@H]1O[C@@H](CNC1)C)F.Cl
Tpsa: 21.26
Logp: 1.3474
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Store at room temperature, keep dry and cool
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₁ClF₃NO
Molecular Weight:
205.61
Synonyms:
None
SMILES:
FC(F)([C@H]1O[C@@H](CNC1)C)F.Cl
Tpsa:
21.26
Logp:
1.3474
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₂₁NO₃
Molecular Weight: 215.29
Synonyms: None
SMILES: CC(C)(C)OC(N([C@H]1C[C@@H](C1)O)CC)=O
Tpsa: 49.77
Logp: 1.7667
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₂₁NO₃
Molecular Weight:
215.29
Synonyms:
None
SMILES:
CC(C)(C)OC(N([C@H]1C[C@@H](C1)O)CC)=O
Tpsa:
49.77
Logp:
1.7667
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2