CS-1141243
3-(Isothiazol-4-yl)propanoic acid
Manufacturer: ChemScene
CAS Number: 1537974-92-7
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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
C₆H₇NO₂S
Molecular Weight
157.19
Synonyms
None
SMILES
O=C(O)CCC=1C=NSC1
Tpsa
50.19
Logp
1.1603
H Acceptors
3
H Donors
1
Rotatable Bonds
3
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: C₆H₇NO₂S
Molecular Weight: 157.19
Synonyms: None
SMILES: O=C(O)CCC=1C=NSC1
Tpsa: 50.19
Logp: 1.1603
H Acceptors: 3
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:
C₆H₇NO₂S
Molecular Weight:
157.19
Synonyms:
None
SMILES:
O=C(O)CCC=1C=NSC1
Tpsa:
50.19
Logp:
1.1603
H Acceptors:
3
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: C₁₂H₁₀Cl₂N₂O₃
Molecular Weight: 301.12
Synonyms: None
SMILES: O=C(OCC)C1=NC(=NO1)CC2=CC=C(Cl)C(Cl)=C2
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₀Cl₂N₂O₃
Molecular Weight:
301.12
Synonyms:
None
SMILES:
O=C(OCC)C1=NC(=NO1)CC2=CC=C(Cl)C(Cl)=C2
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₂N₂O
Molecular Weight: 152.20
Synonyms: None
SMILES: N=1C(=CC(OC)=CC1CN)C
Tpsa: 48.14
Logp: 0.85732
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:
C₈H₁₂N₂O
Molecular Weight:
152.20
Synonyms:
None
SMILES:
N=1C(=CC(OC)=CC1CN)C
Tpsa:
48.14
Logp:
0.85732
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: C₉H₆F₃NO₃
Molecular Weight: 233.15
Synonyms: None
SMILES: O=C(O)C=1N=C(C=C(C1)C(F)(F)F)C(=O)C
Tpsa: 67.26
Logp: 2.0012
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:
C₉H₆F₃NO₃
Molecular Weight:
233.15
Synonyms:
None
SMILES:
O=C(O)C=1N=C(C=C(C1)C(F)(F)F)C(=O)C
Tpsa:
67.26
Logp:
2.0012
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2