CS-1009711
4-[(1S)-1-[(2,2,2-Trifluoroacetyl)amino]ethyl]benzoic acid
Manufacturer: ChemScene
CAS Number: 1415403-15-4
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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
C₁₁H₁₀F₃NO₃
Molecular Weight
261.20
Synonyms
None
SMILES
O=C(O)C1=CC=C([C@@H](NC(C(F)(F)F)=O)C)C=C1
Tpsa
66.4
Logp
2.1243
H Acceptors
2
H Donors
2
Rotatable Bonds
3
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: C₁₁H₁₀F₃NO₃
Molecular Weight: 261.20
Synonyms: None
SMILES: O=C(O)C1=CC=C([C@@H](NC(C(F)(F)F)=O)C)C=C1
Tpsa: 66.4
Logp: 2.1243
H Acceptors: 2
H Donors: 2
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:
C₁₁H₁₀F₃NO₃
Molecular Weight:
261.20
Synonyms:
None
SMILES:
O=C(O)C1=CC=C([C@@H](NC(C(F)(F)F)=O)C)C=C1
Tpsa:
66.4
Logp:
2.1243
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Store at room temperature, keep dry and cool
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₈ClNO₂
Molecular Weight: 149.58
Synonyms: None
SMILES: O=C1[C@]2([H])C[C@](CN2)([H])O1.Cl
Tpsa: 38.33
Logp: -0.3045
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Store at room temperature, keep dry and cool
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₈ClNO₂
Molecular Weight:
149.58
Synonyms:
None
SMILES:
O=C1[C@]2([H])C[C@](CN2)([H])O1.Cl
Tpsa:
38.33
Logp:
-0.3045
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₀N₂O₂
Molecular Weight: 202.21
Synonyms: None
SMILES: O=CC1=CC2=C(C=C(CC)C(N2)=O)N=C1
Tpsa: 62.82
Logp: 1.298
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₀N₂O₂
Molecular Weight:
202.21
Synonyms:
None
SMILES:
O=CC1=CC2=C(C=C(CC)C(N2)=O)N=C1
Tpsa:
62.82
Logp:
1.298
H Acceptors:
3
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: C₇H₈N₂O₃
Molecular Weight: 168.15
Synonyms: None
SMILES: [O-][N+](C1=NC=C(C=C1)OCC)=O
Tpsa: 65.26
Logp: 1.3885
H Acceptors: 4
H Donors: 0
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:
C₇H₈N₂O₃
Molecular Weight:
168.15
Synonyms:
None
SMILES:
[O-][N+](C1=NC=C(C=C1)OCC)=O
Tpsa:
65.26
Logp:
1.3885
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3