CS-0721603
rel-(1R,2R)-4-Oxo-2-(3-thienyl)cyclohexanecarboxylic acid
Manufacturer: ChemScene
CAS Number: 1269470-33-8
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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
C₁₁H₁₂O₃S
Molecular Weight
224.28
Synonyms
None
SMILES
OC(=O)[C@H]1CCC(=O)C[C@@H]1C1=CSC=C1
Tpsa
54.37
Logp
2.2855
H Acceptors
3
H Donors
1
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂O₃S
Molecular Weight: 224.28
Synonyms: None
SMILES: OC(=O)[C@H]1CCC(=O)C[C@@H]1C1=CSC=C1
Tpsa: 54.37
Logp: 2.2855
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:
C₁₁H₁₂O₃S
Molecular Weight:
224.28
Synonyms:
None
SMILES:
OC(=O)[C@H]1CCC(=O)C[C@@H]1C1=CSC=C1
Tpsa:
54.37
Logp:
2.2855
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: C₈H₁₃NOS
Molecular Weight: 171.26
Synonyms: None
SMILES: CC(C)(C)C1=CN=C(CO)S1
Tpsa: 33.12
Logp: 1.9329
H Acceptors: 3
H Donors: 1
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:
C₈H₁₃NOS
Molecular Weight:
171.26
Synonyms:
None
SMILES:
CC(C)(C)C1=CN=C(CO)S1
Tpsa:
33.12
Logp:
1.9329
H Acceptors:
3
H Donors:
1
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: C₁₁H₁₅NO₂
Molecular Weight: 193.24
Synonyms: None
SMILES: CC1(C)OCC2=C(O1)C=CC(CN)=C2
Tpsa: 44.48
Logp: 1.7904
H Acceptors: 3
H Donors: 1
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:
C₁₁H₁₅NO₂
Molecular Weight:
193.24
Synonyms:
None
SMILES:
CC1(C)OCC2=C(O1)C=CC(CN)=C2
Tpsa:
44.48
Logp:
1.7904
H Acceptors:
3
H Donors:
1
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: C₈H₁₈N₂
Molecular Weight: 142.24
Synonyms: None
SMILES: CCN1CC[C@@H](CCN)C1
Tpsa: 29.26
Logp: 0.677
H Acceptors: 2
H Donors: 1
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:
C₈H₁₈N₂
Molecular Weight:
142.24
Synonyms:
None
SMILES:
CCN1CC[C@@H](CCN)C1
Tpsa:
29.26
Logp:
0.677
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3