CS-0756834
Methyl 4-bromo-1-(4-methoxybenzyl)-3-(trifluoromethyl)-1h-pyrazole-5-carboxylate
Manufacturer: ChemScene
CAS Number: 1956382-97-0
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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
C₁₄H₁₂BrF₃N₂O₃
Molecular Weight
393.16
Synonyms
None
SMILES
COC(=O)C1=C(Br)C(=NN1CC1=CC=C(OC)C=C1)C(F)(F)F
Tpsa
53.35
Logp
3.5079
H Acceptors
5
H Donors
0
Rotatable Bonds
4
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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: C₁₄H₁₂BrF₃N₂O₃
Molecular Weight: 393.16
Synonyms: None
SMILES: COC(=O)C1=C(Br)C(=NN1CC1=CC=C(OC)C=C1)C(F)(F)F
Tpsa: 53.35
Logp: 3.5079
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₂BrF₃N₂O₃
Molecular Weight:
393.16
Synonyms:
None
SMILES:
COC(=O)C1=C(Br)C(=NN1CC1=CC=C(OC)C=C1)C(F)(F)F
Tpsa:
53.35
Logp:
3.5079
H Acceptors:
5
H Donors:
0
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: C₇H₅BrCl₂N₂
Molecular Weight: 267.94
Synonyms: None
SMILES: Cl.NC1=C(C=C(Br)C(Cl)=C1)C#N
Tpsa: 49.81
Logp: 2.97818
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₅BrCl₂N₂
Molecular Weight:
267.94
Synonyms:
None
SMILES:
Cl.NC1=C(C=C(Br)C(Cl)=C1)C#N
Tpsa:
49.81
Logp:
2.97818
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD07787603
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂H₅N₃O₂S
Molecular Weight: 135.15
Synonyms: N-Nitro-S-methylisothiourea
SMILES: CSC(N)=N[N+]([O-])=O
Tpsa: 81.52
Logp: -0.1442
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD07787603
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂H₅N₃O₂S
Molecular Weight:
135.15
Synonyms:
N-Nitro-S-methylisothiourea
SMILES:
CSC(N)=N[N+]([O-])=O
Tpsa:
81.52
Logp:
-0.1442
H Acceptors:
3
H Donors:
1
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: C₁₃H₁₈N₂O₂
Molecular Weight: 234.29
Synonyms: None
SMILES: CCOC(=O)C1=CC(=CC=C1)N1CCNCC1
Tpsa: 41.57
Logp: 1.2729
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₈N₂O₂
Molecular Weight:
234.29
Synonyms:
None
SMILES:
CCOC(=O)C1=CC(=CC=C1)N1CCNCC1
Tpsa:
41.57
Logp:
1.2729
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3