CS-1170371
7-Oxo-4,5,6,7-tetrahydro-1H-indole-3-sulfonic acid
Manufacturer: ChemScene
CAS Number: 3041032-68-9
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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
C₈H₉NO₄S
Molecular Weight
215.23
Synonyms
None
SMILES
O=S(C1=CNC2=C1CCCC2=O)(O)=O
Tpsa
87.23
Logp
0.7804
H Acceptors
3
H Donors
2
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: C₈H₉NO₄S
Molecular Weight: 215.23
Synonyms: None
SMILES: O=S(C1=CNC2=C1CCCC2=O)(O)=O
Tpsa: 87.23
Logp: 0.7804
H Acceptors: 3
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:
C₈H₉NO₄S
Molecular Weight:
215.23
Synonyms:
None
SMILES:
O=S(C1=CNC2=C1CCCC2=O)(O)=O
Tpsa:
87.23
Logp:
0.7804
H Acceptors:
3
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: C₁₁H₁₁F₄N
Molecular Weight: 233.21
Synonyms: None
SMILES: N[C@H](C1CC1)C2=CC=C(C(F)(F)F)C=C2F
Tpsa: 26.02
Logp: 3.2543
H Acceptors: 1
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:
C₁₁H₁₁F₄N
Molecular Weight:
233.21
Synonyms:
None
SMILES:
N[C@H](C1CC1)C2=CC=C(C(F)(F)F)C=C2F
Tpsa:
26.02
Logp:
3.2543
H Acceptors:
1
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: C₁₀H₁₀N₂O₃
Molecular Weight: 206.20
Synonyms: None
SMILES: O=C(OC)CC1=CN2C=CC(O)=CC2=N1
Tpsa: 63.83
Logp: 0.7554
H Acceptors: 5
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:
C₁₀H₁₀N₂O₃
Molecular Weight:
206.20
Synonyms:
None
SMILES:
O=C(OC)CC1=CN2C=CC(O)=CC2=N1
Tpsa:
63.83
Logp:
0.7554
H Acceptors:
5
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: C₁₂H₁₂ClFN₂O₂
Molecular Weight: 270.69
Synonyms: None
SMILES: N#CC1=C(F)C=C(Cl)C(NC(OC(C)(C)C)=O)=C1
Tpsa: 62.12
Logp: 3.69778
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:
C₁₂H₁₂ClFN₂O₂
Molecular Weight:
270.69
Synonyms:
None
SMILES:
N#CC1=C(F)C=C(Cl)C(NC(OC(C)(C)C)=O)=C1
Tpsa:
62.12
Logp:
3.69778
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1