CS-0887538
3-Chloro-5-cyano-2-methylbenzoic acid
Manufacturer: ChemScene
CAS Number: 1805564-84-4
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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#N)=CC(Cl)=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#N)=CC(Cl)=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#N)=CC(Cl)=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: C₆H₅ClN₄
Molecular Weight: 168.58
Synonyms: None
SMILES: N#CC1=C(C)C(Cl)=NN=C1N
Tpsa: 75.59
Logp: 0.8923
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₅ClN₄
Molecular Weight:
168.58
Synonyms:
None
SMILES:
N#CC1=C(C)C(Cl)=NN=C1N
Tpsa:
75.59
Logp:
0.8923
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₄F₃N
Molecular Weight: 171.12
Synonyms: None
SMILES: N#CC1=CC(F)=C(F)C(C)=C1F
Tpsa: 23.79
Logp: 2.284
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₄F₃N
Molecular Weight:
171.12
Synonyms:
None
SMILES:
N#CC1=CC(F)=C(F)C(C)=C1F
Tpsa:
23.79
Logp:
2.284
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆FNO₂
Molecular Weight: 179.15
Synonyms: None
SMILES: O=C(O)C1=CC(C#N)=CC(F)=C1C
Tpsa: 61.09
Logp: 1.704
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:
C₉H₆FNO₂
Molecular Weight:
179.15
Synonyms:
None
SMILES:
O=C(O)C1=CC(C#N)=CC(F)=C1C
Tpsa:
61.09
Logp:
1.704
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1