CS-0747277
4-(Tert-butyl)-2-((3-chloro-2-(methylthio)phenyl)amino)benzoic acid
Manufacturer: ChemScene
CAS Number: 2332808-31-6
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Purity
98%
MDL No
MFCD34181787
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₈H₂₀ClNO₂S
Molecular Weight
349.87
Synonyms
None
SMILES
CSC1=C(NC2=C(C=CC(=C2)C(C)(C)C)C(O)=O)C=CC=C1Cl
Tpsa
49.33
Logp
5.8012
H Acceptors
3
H Donors
2
Rotatable Bonds
4
Related Products
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: MFCD34181787
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₀ClNO₂S
Molecular Weight: 349.87
Synonyms: None
SMILES: CSC1=C(NC2=C(C=CC(=C2)C(C)(C)C)C(O)=O)C=CC=C1Cl
Tpsa: 49.33
Logp: 5.8012
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
MFCD34181787
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₀ClNO₂S
Molecular Weight:
349.87
Synonyms:
None
SMILES:
CSC1=C(NC2=C(C=CC(=C2)C(C)(C)C)C(O)=O)C=CC=C1Cl
Tpsa:
49.33
Logp:
5.8012
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₅NO₄
Molecular Weight: 249.26
Synonyms: None
SMILES: COC1=CC=C(CNC(=O)C2CCC(=O)O2)C=C1
Tpsa: 64.63
Logp: 1.017
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₅NO₄
Molecular Weight:
249.26
Synonyms:
None
SMILES:
COC1=CC=C(CNC(=O)C2CCC(=O)O2)C=C1
Tpsa:
64.63
Logp:
1.017
H Acceptors:
4
H Donors:
1
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: C₉H₁₆ClNO₃
Molecular Weight: 221.68
Synonyms: None
SMILES: Cl.OC(=O)C1CC2(CN1)CCOCC2
Tpsa: 58.56
Logp: 0.6515
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:
C₉H₁₆ClNO₃
Molecular Weight:
221.68
Synonyms:
None
SMILES:
Cl.OC(=O)C1CC2(CN1)CCOCC2
Tpsa:
58.56
Logp:
0.6515
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: C₁₆H₂₁IN₂O₃
Molecular Weight: 416.25
Synonyms: None
SMILES: CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NC1=CC=C(I)C=C1
Tpsa: 58.64
Logp: 3.6292
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:
C₁₆H₂₁IN₂O₃
Molecular Weight:
416.25
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NC1=CC=C(I)C=C1
Tpsa:
58.64
Logp:
3.6292
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2