CS-0628855
4-Chloro-3-cyano-2-methylbenzoic acid
Manufacturer: ChemScene
CAS Number: 1805497-50-0
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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
C₉H₆ClNO₂
Molecular Weight
195.60
Synonyms
None
SMILES
O=C(O)C1=CC=C(Cl)C(C#N)=C1C
Tpsa
61.09
Logp
2.2183
H Acceptors
2
H Donors
1
Rotatable Bonds
1
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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: C₉H₆ClNO₂
Molecular Weight: 195.60
Synonyms: None
SMILES: O=C(O)C1=CC=C(Cl)C(C#N)=C1C
Tpsa: 61.09
Logp: 2.2183
H Acceptors: 2
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:
C₉H₆ClNO₂
Molecular Weight:
195.60
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(Cl)C(C#N)=C1C
Tpsa:
61.09
Logp:
2.2183
H Acceptors:
2
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: C₁₀H₈ClNO₂
Molecular Weight: 209.63
Synonyms: None
SMILES: O=C(OC)C1=CC=C(Cl)C(C#N)=C1C
Tpsa: 50.09
Logp: 2.3067
H Acceptors: 3
H Donors: 0
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:
C₁₀H₈ClNO₂
Molecular Weight:
209.63
Synonyms:
None
SMILES:
O=C(OC)C1=CC=C(Cl)C(C#N)=C1C
Tpsa:
50.09
Logp:
2.3067
H Acceptors:
3
H Donors:
0
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: C₈H₇BrF₃N
Molecular Weight: 254.05
Synonyms: None
SMILES: FC(C1=NC=CC(C(Br)C)=C1)(F)F
Tpsa: 12.89
Logp: 3.5563
H Acceptors: 1
H Donors: 0
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:
C₈H₇BrF₃N
Molecular Weight:
254.05
Synonyms:
None
SMILES:
FC(C1=NC=CC(C(Br)C)=C1)(F)F
Tpsa:
12.89
Logp:
3.5563
H Acceptors:
1
H Donors:
0
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: C₁₀H₈ClF₃O₅S
Molecular Weight: 332.68
Synonyms: None
SMILES: O=C(OC)C1=CC=C(Cl)C(OS(=O)(C(F)(F)F)=O)=C1C
Tpsa: 69.67
Logp: 2.66342
H Acceptors: 5
H Donors: 0
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:
C₁₀H₈ClF₃O₅S
Molecular Weight:
332.68
Synonyms:
None
SMILES:
O=C(OC)C1=CC=C(Cl)C(OS(=O)(C(F)(F)F)=O)=C1C
Tpsa:
69.67
Logp:
2.66342
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3