CS-0253984
2-(5-Fluoro-1H-inden-3-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 1049800-33-0
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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
C₁₁H₉FO₂
Molecular Weight
192.19
Synonyms
None
SMILES
O=C(O)CC1=CCC2=C1C=C(F)C=C2
Tpsa
37.3
Logp
2.2399
H Acceptors
1
H Donors
1
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
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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: C₁₁H₉FO₂
Molecular Weight: 192.19
Synonyms: None
SMILES: O=C(O)CC1=CCC2=C1C=C(F)C=C2
Tpsa: 37.3
Logp: 2.2399
H Acceptors: 1
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:
C₁₁H₉FO₂
Molecular Weight:
192.19
Synonyms:
None
SMILES:
O=C(O)CC1=CCC2=C1C=C(F)C=C2
Tpsa:
37.3
Logp:
2.2399
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆F₃NO
Molecular Weight: 201.15
Synonyms: Benzonitrile, 4-(2,2,2-trifluoro-1-hydroxyethyl)- (9CI)
SMILES: N#CC1=CC=C(C(O)C(F)(F)F)C=C1
Tpsa: 44.02
Logp: 2.15398
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₆F₃NO
Molecular Weight:
201.15
Synonyms:
Benzonitrile, 4-(2,2,2-trifluoro-1-hydroxyethyl)- (9CI)
SMILES:
N#CC1=CC=C(C(O)C(F)(F)F)C=C1
Tpsa:
44.02
Logp:
2.15398
H Acceptors:
2
H Donors:
1
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: C₉H₁₀F₃NO
Molecular Weight: 205.18
Synonyms: None
SMILES: FC(F)(C(C1=CC=C(CN)C=C1)O)F
Tpsa: 46.25
Logp: 1.741
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:
C₉H₁₀F₃NO
Molecular Weight:
205.18
Synonyms:
None
SMILES:
FC(F)(C(C1=CC=C(CN)C=C1)O)F
Tpsa:
46.25
Logp:
1.741
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: C₉H₈F₃NO₄
Molecular Weight: 251.16
Synonyms: None
SMILES: [O-][N+](C1=CC(OC)=CC=C1C(C(F)(F)F)O)=O
Tpsa: 72.6
Logp: 2.1991
H Acceptors: 4
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:
C₉H₈F₃NO₄
Molecular Weight:
251.16
Synonyms:
None
SMILES:
[O-][N+](C1=CC(OC)=CC=C1C(C(F)(F)F)O)=O
Tpsa:
72.6
Logp:
2.1991
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3