CS-1013737
2,3-Dihydrobenzo[b]thiophene-7-carboxylic acid 1,1-dioxide
Manufacturer: ChemScene
CAS Number: 1541843-15-5
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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
C₉H₈O₄S
Molecular Weight
212.22
Synonyms
None
SMILES
O=C(C1=C2C(CCS2(=O)=O)=CC=C1)O
Tpsa
71.44
Logp
0.7146
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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: C₉H₈O₄S
Molecular Weight: 212.22
Synonyms: None
SMILES: O=C(C1=C2C(CCS2(=O)=O)=CC=C1)O
Tpsa: 71.44
Logp: 0.7146
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:
C₉H₈O₄S
Molecular Weight:
212.22
Synonyms:
None
SMILES:
O=C(C1=C2C(CCS2(=O)=O)=CC=C1)O
Tpsa:
71.44
Logp:
0.7146
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: C₈H₈O₃S
Molecular Weight: 184.21
Synonyms: None
SMILES: OC1=C(CCS2(=O)=O)C2=CC=C1
Tpsa: 54.37
Logp: 0.722
H Acceptors: 3
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:
C₈H₈O₃S
Molecular Weight:
184.21
Synonyms:
None
SMILES:
OC1=C(CCS2(=O)=O)C2=CC=C1
Tpsa:
54.37
Logp:
0.722
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇BrFNO
Molecular Weight: 244.06
Synonyms: None
SMILES: O=C(C1=NC=C(Br)C=C1F)C2CC2
Tpsa: 29.96
Logp: 2.5759
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇BrFNO
Molecular Weight:
244.06
Synonyms:
None
SMILES:
O=C(C1=NC=C(Br)C=C1F)C2CC2
Tpsa:
29.96
Logp:
2.5759
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₂F₃N₅O
Molecular Weight: 417.43
Synonyms: None
SMILES: O=C(C1=CC(NC)=NC=C1)N[C@H]2CC[C@@H](NC3=CC=C(C#N)C(C(F)(F)F)=C3)CC2
Tpsa: 89.84
Logp: 4.16688
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₂F₃N₅O
Molecular Weight:
417.43
Synonyms:
None
SMILES:
O=C(C1=CC(NC)=NC=C1)N[C@H]2CC[C@@H](NC3=CC=C(C#N)C(C(F)(F)F)=C3)CC2
Tpsa:
89.84
Logp:
4.16688
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
5