CS-0587515
3-(3,5-Difluorophenyl)propiolic acid
Manufacturer: ChemScene
CAS Number: 935475-83-5
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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
C₉H₄F₂O₂
Molecular Weight
182.12
Synonyms
None
SMILES
O=C(O)C#CC1=CC(F)=CC(F)=C1
Tpsa
37.3
Logp
1.4009
H Acceptors
1
H Donors
1
Rotatable Bonds
0
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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: C₉H₄F₂O₂
Molecular Weight: 182.12
Synonyms: None
SMILES: O=C(O)C#CC1=CC(F)=CC(F)=C1
Tpsa: 37.3
Logp: 1.4009
H Acceptors: 1
H Donors: 1
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:
C₉H₄F₂O₂
Molecular Weight:
182.12
Synonyms:
None
SMILES:
O=C(O)C#CC1=CC(F)=CC(F)=C1
Tpsa:
37.3
Logp:
1.4009
H Acceptors:
1
H Donors:
1
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: C₇H₆F₃NS
Molecular Weight: 193.19
Synonyms: 4-Mercapto-2-(trifluoromethyl)aniline
SMILES: NC1=CC=C(S)C=C1C(F)(F)F
Tpsa: 26.02
Logp: 2.5763
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:
C₇H₆F₃NS
Molecular Weight:
193.19
Synonyms:
4-Mercapto-2-(trifluoromethyl)aniline
SMILES:
NC1=CC=C(S)C=C1C(F)(F)F
Tpsa:
26.02
Logp:
2.5763
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: C₁₀H₁₄ClN₃
Molecular Weight: 211.69
Synonyms: None
SMILES: NN1CCN(C2=CC=CC=C2Cl)CC1
Tpsa: 32.5
Logp: 1.3357
H Acceptors: 3
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:
C₁₀H₁₄ClN₃
Molecular Weight:
211.69
Synonyms:
None
SMILES:
NN1CCN(C2=CC=CC=C2Cl)CC1
Tpsa:
32.5
Logp:
1.3357
H Acceptors:
3
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: C₉H₁₆O₅
Molecular Weight: 204.22
Synonyms: MALIC ACID, 3-METHYL-, DIETHYL ESTER
SMILES: CCOC(=O)C(C)C(C(=O)OCC)O
Tpsa: 72.83
Logp: 0.1096
H Acceptors: 5
H Donors: 1
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:
C₉H₁₆O₅
Molecular Weight:
204.22
Synonyms:
MALIC ACID, 3-METHYL-, DIETHYL ESTER
SMILES:
CCOC(=O)C(C)C(C(=O)OCC)O
Tpsa:
72.83
Logp:
0.1096
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
5