CS-0915551
Benzoic acid, 4-amino-3-(trifluoromethoxy)-, methyl ester, hydrochloride
Manufacturer: ChemScene
CAS Number: 1011531-66-0
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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
C₉H₉ClF₃NO₃
Molecular Weight
271.62
Synonyms
None
SMILES
Cl.O=C(OC)C1=CC=C(N)C(OC(F)(F)F)=C1
Tpsa
61.55
Logp
2.3758
H Acceptors
4
H Donors
1
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1011531-66-0 | 4-Amino-3-(trifluoromethoxy)benzoic acid meth yl ester hydrochloride | A2B Chem | -- |
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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: C₉H₉ClF₃NO₃
Molecular Weight: 271.62
Synonyms: None
SMILES: Cl.O=C(OC)C1=CC=C(N)C(OC(F)(F)F)=C1
Tpsa: 61.55
Logp: 2.3758
H Acceptors: 4
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:
C₉H₉ClF₃NO₃
Molecular Weight:
271.62
Synonyms:
None
SMILES:
Cl.O=C(OC)C1=CC=C(N)C(OC(F)(F)F)=C1
Tpsa:
61.55
Logp:
2.3758
H Acceptors:
4
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: C₁₃H₂₆ClN₃
Molecular Weight: 259.82
Synonyms: None
SMILES: [C@@](C)(C)(C)[C@@H]1NC2=[N+](C[C@H](C(C)(C)C)N2)C1.[Cl-]
Tpsa: 27.07
Logp: -1.6053
H Acceptors: 2
H Donors: 2
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:
C₁₃H₂₆ClN₃
Molecular Weight:
259.82
Synonyms:
None
SMILES:
[C@@](C)(C)(C)[C@@H]1NC2=[N+](C[C@H](C(C)(C)C)N2)C1.[Cl-]
Tpsa:
27.07
Logp:
-1.6053
H Acceptors:
2
H Donors:
2
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: C₁₂H₂₂N₂O₆
Molecular Weight: 290.31
Synonyms: None
SMILES: C(C(O)=O)(O)=O.N(C(OC(C)(C)C)=O)[C@H]1C[C@@H](N)CC1
Tpsa: 138.95
Logp: 0.5465
H Acceptors: 5
H Donors: 4
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:
C₁₂H₂₂N₂O₆
Molecular Weight:
290.31
Synonyms:
None
SMILES:
C(C(O)=O)(O)=O.N(C(OC(C)(C)C)=O)[C@H]1C[C@@H](N)CC1
Tpsa:
138.95
Logp:
0.5465
H Acceptors:
5
H Donors:
4
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: C₆H₁₀CaO₇
Molecular Weight: 234.22
Synonyms: None
SMILES: [C@H]([C@@H](C(CO)=O)O)([C@H](C(O)=O)O)O.[Ca]
Tpsa: 135.29
Logp: -3.6657
H Acceptors: 6
H Donors: 5
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₀CaO₇
Molecular Weight:
234.22
Synonyms:
None
SMILES:
[C@H]([C@@H](C(CO)=O)O)([C@H](C(O)=O)O)O.[Ca]
Tpsa:
135.29
Logp:
-3.6657
H Acceptors:
6
H Donors:
5
Rotatable Bonds:
5