CS-0747289
4-[[4-Chloro-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3-methoxybenzoic acid
Manufacturer: ChemScene
CAS Number: 869937-03-1
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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
C₁₃H₉ClF₃N₃O₃
Molecular Weight
347.68
Synonyms
None
SMILES
COC1=CC(=CC=C1NC1=NC=C(C(Cl)=N1)C(F)(F)F)C(O)=O
Tpsa
84.34
Logp
3.5992
H Acceptors
5
H Donors
2
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: C₁₃H₉ClF₃N₃O₃
Molecular Weight: 347.68
Synonyms: None
SMILES: COC1=CC(=CC=C1NC1=NC=C(C(Cl)=N1)C(F)(F)F)C(O)=O
Tpsa: 84.34
Logp: 3.5992
H Acceptors: 5
H Donors: 2
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:
C₁₃H₉ClF₃N₃O₃
Molecular Weight:
347.68
Synonyms:
None
SMILES:
COC1=CC(=CC=C1NC1=NC=C(C(Cl)=N1)C(F)(F)F)C(O)=O
Tpsa:
84.34
Logp:
3.5992
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
4
Purity: 96%
MDL No: MFCD28156515
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₆Cl₂O₂
Molecular Weight: 287.18
Synonyms: None
SMILES: COC1=C(Cl)C(Cl)=C(C=C1)C(=O)CC1CCCC1
Tpsa: 26.3
Logp: 4.765
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 4
Purity:
96%
MDL No:
MFCD28156515
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₆Cl₂O₂
Molecular Weight:
287.18
Synonyms:
None
SMILES:
COC1=C(Cl)C(Cl)=C(C=C1)C(=O)CC1CCCC1
Tpsa:
26.3
Logp:
4.765
H Acceptors:
2
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: C₁₃H₂₃NO₅
Molecular Weight: 273.33
Synonyms: None
SMILES: CCOC(=O)C1CCN(C1CO)C(=O)OC(C)(C)C
Tpsa: 76.07
Logp: 1.1674
H Acceptors: 5
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:
C₁₃H₂₃NO₅
Molecular Weight:
273.33
Synonyms:
None
SMILES:
CCOC(=O)C1CCN(C1CO)C(=O)OC(C)(C)C
Tpsa:
76.07
Logp:
1.1674
H Acceptors:
5
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: C₁₁H₁₉NO₅
Molecular Weight: 245.27
Synonyms: None
SMILES: CC(C)(C)OC(=O)N1CCC(C1CO)C(O)=O
Tpsa: 87.07
Logp: 0.6889
H Acceptors: 4
H Donors: 2
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:
C₁₁H₁₉NO₅
Molecular Weight:
245.27
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N1CCC(C1CO)C(O)=O
Tpsa:
87.07
Logp:
0.6889
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2