CS-0914411
4-(5-(p-tolyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)benzenesulfonic acid
Manufacturer: ChemScene
CAS Number: 921617-76-7
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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
C₁₇H₁₃F₃N₂O₃S
Molecular Weight
382.36
Synonyms
None
SMILES
O=S(=O)(O)C1=CC=C(C=C1)N2N=C(C=C2C=3C=CC(=CC3)C)C(F)(F)F
Tpsa
72.19
Logp
4.11322
H Acceptors
4
H Donors
1
Rotatable Bonds
3
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₇H₁₃F₃N₂O₃S
Molecular Weight: 382.36
Synonyms: None
SMILES: O=S(=O)(O)C1=CC=C(C=C1)N2N=C(C=C2C=3C=CC(=CC3)C)C(F)(F)F
Tpsa: 72.19
Logp: 4.11322
H Acceptors: 4
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:
C₁₇H₁₃F₃N₂O₃S
Molecular Weight:
382.36
Synonyms:
None
SMILES:
O=S(=O)(O)C1=CC=C(C=C1)N2N=C(C=C2C=3C=CC(=CC3)C)C(F)(F)F
Tpsa:
72.19
Logp:
4.11322
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 97%
MDL No: MFCD27966879
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₉BrClN
Molecular Weight: 282.56
Synonyms: None
SMILES: ClC1=CC=CC(Br)=C1NC=2C=CC=CC2
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
97%
MDL No:
MFCD27966879
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₉BrClN
Molecular Weight:
282.56
Synonyms:
None
SMILES:
ClC1=CC=CC(Br)=C1NC=2C=CC=CC2
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₉Cl₂N
Molecular Weight: 238.11
Synonyms: None
SMILES: ClC1=CC=C(NC=2C=CC=CC2)C(Cl)=C1
Tpsa: 12.03
Logp: 4.737
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₉Cl₂N
Molecular Weight:
238.11
Synonyms:
None
SMILES:
ClC1=CC=C(NC=2C=CC=CC2)C(Cl)=C1
Tpsa:
12.03
Logp:
4.737
H Acceptors:
1
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: C₁₂H₈Cl₃N
Molecular Weight: 272.56
Synonyms: None
SMILES: ClC=1C=C(Cl)C(NC=2C=CC=CC2)=C(Cl)C1
Tpsa: 12.03
Logp: 5.3904
H Acceptors: 1
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:
C₁₂H₈Cl₃N
Molecular Weight:
272.56
Synonyms:
None
SMILES:
ClC=1C=C(Cl)C(NC=2C=CC=CC2)=C(Cl)C1
Tpsa:
12.03
Logp:
5.3904
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2