CS-0771240
6-[(4-Nitrophenyl)Sulfanyl]nicotinic acid
Manufacturer: ChemScene
CAS Number: 873392-05-3
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₈N₂O₄S
Molecular Weight
276.27
Synonyms
None
SMILES
OC(=O)C1=CC=C(SC2=CC=C(C=C2)[N+]([O-])=O)N=C1
Tpsa
93.33
Logp
2.8392
H Acceptors
5
H Donors
1
Rotatable Bonds
4
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₈N₂O₄S
Molecular Weight: 276.27
Synonyms: None
SMILES: OC(=O)C1=CC=C(SC2=CC=C(C=C2)[N+]([O-])=O)N=C1
Tpsa: 93.33
Logp: 2.8392
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₈N₂O₄S
Molecular Weight:
276.27
Synonyms:
None
SMILES:
OC(=O)C1=CC=C(SC2=CC=C(C=C2)[N+]([O-])=O)N=C1
Tpsa:
93.33
Logp:
2.8392
H Acceptors:
5
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: C₁₁H₁₃BrO₃
Molecular Weight: 273.12
Synonyms: None
SMILES: COC(=O)CCCOC1=CC=CC(Br)=C1
Tpsa: 35.53
Logp: 2.7811
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 5
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₃BrO₃
Molecular Weight:
273.12
Synonyms:
None
SMILES:
COC(=O)CCCOC1=CC=CC(Br)=C1
Tpsa:
35.53
Logp:
2.7811
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
5
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₄O₃
Molecular Weight: 170.21
Synonyms: None
SMILES: COC(=O)C1CCC(C)C(=O)C1
Tpsa: 43.37
Logp: 1.1647
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₄O₃
Molecular Weight:
170.21
Synonyms:
None
SMILES:
COC(=O)C1CCC(C)C(=O)C1
Tpsa:
43.37
Logp:
1.1647
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₉BrO
Molecular Weight: 165.03
Synonyms: None
SMILES: CC1CC(Br)CO1
Tpsa: 9.23
Logp: 1.5587
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₉BrO
Molecular Weight:
165.03
Synonyms:
None
SMILES:
CC1CC(Br)CO1
Tpsa:
9.23
Logp:
1.5587
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0