CS-0883590
2-(Aminomethyl)-5-(trifluoromethyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1822767-92-9
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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
C₉H₈F₃NO₂
Molecular Weight
219.16
Synonyms
None
SMILES
O=C(O)C1=CC(C(F)(F)F)=CC=C1CN
Tpsa
63.32
Logp
1.8623
H Acceptors
2
H Donors
2
Rotatable Bonds
2
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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: C₉H₈F₃NO₂
Molecular Weight: 219.16
Synonyms: None
SMILES: O=C(O)C1=CC(C(F)(F)F)=CC=C1CN
Tpsa: 63.32
Logp: 1.8623
H Acceptors: 2
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:
C₉H₈F₃NO₂
Molecular Weight:
219.16
Synonyms:
None
SMILES:
O=C(O)C1=CC(C(F)(F)F)=CC=C1CN
Tpsa:
63.32
Logp:
1.8623
H Acceptors:
2
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: C₅₅H₃₄N₆
Molecular Weight: 778.90
Synonyms: None
SMILES: C1(C=CC(C2=CC(C3=CC=CC=N3)=NC(C4=NC=CC=C4)=C2)=C5)=C5C6(C(C=CC=C7)=C7C8=C6C=CC=C8)C9=C1C=CC(C%10=CC(C%11=CC=CC=N%11)=NC(C%12=NC=CC=C%12)=C%10)=C9
Tpsa: 77.34
Logp: 12.4021
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₅H₃₄N₆
Molecular Weight:
778.90
Synonyms:
None
SMILES:
C1(C=CC(C2=CC(C3=CC=CC=N3)=NC(C4=NC=CC=C4)=C2)=C5)=C5C6(C(C=CC=C7)=C7C8=C6C=CC=C8)C9=C1C=CC(C%10=CC(C%11=CC=CC=N%11)=NC(C%12=NC=CC=C%12)=C%10)=C9
Tpsa:
77.34
Logp:
12.4021
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₀BrF₄NO₄
Molecular Weight: 458.24
Synonyms: None
SMILES: O=C(N(C1=CC=C(C(F)=C1C(F)(F)F)Br)C(OC(C)(C)C)=O)OC(C)(C)C
Tpsa: 55.84
Logp: 6.2836
H Acceptors: 4
H Donors: 0
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:
C₁₇H₂₀BrF₄NO₄
Molecular Weight:
458.24
Synonyms:
None
SMILES:
O=C(N(C1=CC=C(C(F)=C1C(F)(F)F)Br)C(OC(C)(C)C)=O)OC(C)(C)C
Tpsa:
55.84
Logp:
6.2836
H Acceptors:
4
H Donors:
0
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: C₉H₉NO₄
Molecular Weight: 195.17
Synonyms: None
SMILES: O=C(C1=C(CN)C=C(OCO2)C2=C1)O
Tpsa: 81.78
Logp: 0.5722
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:
C₉H₉NO₄
Molecular Weight:
195.17
Synonyms:
None
SMILES:
O=C(C1=C(CN)C=C(OCO2)C2=C1)O
Tpsa:
81.78
Logp:
0.5722
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2