CS-0895351
2-(3-Bromo-5-cyanophenyl)acetic acid
Manufacturer: ChemScene
CAS Number: 1261446-12-1
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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
C₉H₆BrNO₂
Molecular Weight
240.05
Synonyms
None
SMILES
N#CC1=CC(Br)=CC(=C1)CC(=O)O
Tpsa
61.09
Logp
1.94788
H Acceptors
2
H Donors
1
Rotatable Bonds
2
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₉H₆BrNO₂
Molecular Weight: 240.05
Synonyms: None
SMILES: N#CC1=CC(Br)=CC(=C1)CC(=O)O
Tpsa: 61.09
Logp: 1.94788
H Acceptors: 2
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:
C₉H₆BrNO₂
Molecular Weight:
240.05
Synonyms:
None
SMILES:
N#CC1=CC(Br)=CC(=C1)CC(=O)O
Tpsa:
61.09
Logp:
1.94788
H Acceptors:
2
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: C₁₀H₆ClF₃N₂S
Molecular Weight: 278.68
Synonyms: None
SMILES: FC(F)(F)C=1C=CC(=CC1Cl)C=2N=C(SC2)N
Tpsa: 38.91
Logp: 4.0645
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:
C₁₀H₆ClF₃N₂S
Molecular Weight:
278.68
Synonyms:
None
SMILES:
FC(F)(F)C=1C=CC(=CC1Cl)C=2N=C(SC2)N
Tpsa:
38.91
Logp:
4.0645
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: C₁₁H₈N₂S
Molecular Weight: 200.26
Synonyms: None
SMILES: C#CC=1C=CC(=CC1)C=2N=C(SC2)N
Tpsa: 38.91
Logp: 2.3736
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:
C₁₁H₈N₂S
Molecular Weight:
200.26
Synonyms:
None
SMILES:
C#CC=1C=CC(=CC1)C=2N=C(SC2)N
Tpsa:
38.91
Logp:
2.3736
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD29120271
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₄N₂O₃
Molecular Weight: 176.13
Synonyms: None
SMILES: N#CC=1C(C=O)=CC=CC1N(=O)=O
Tpsa: 84
Logp: 1.27898
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD29120271
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₄N₂O₃
Molecular Weight:
176.13
Synonyms:
None
SMILES:
N#CC=1C(C=O)=CC=CC1N(=O)=O
Tpsa:
84
Logp:
1.27898
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2