CS-1001469
Ethyl 3-hydroxy-2-[[[4-(trifluoromethyl)phenyl]amino]carbonyl]-2-butenoate
Manufacturer: ChemScene
CAS Number: 145208-39-5
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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
C₁₄H₁₄F₃NO₄
Molecular Weight
317.26
Synonyms
None
SMILES
O=C(OCC)C(C(=O)NC1=CC=C(C=C1)C(F)(F)F)=C(O)C
Tpsa
75.63
Logp
3.039
H Acceptors
4
H Donors
2
Rotatable Bonds
4
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₄H₁₄F₃NO₄
Molecular Weight: 317.26
Synonyms: None
SMILES: O=C(OCC)C(C(=O)NC1=CC=C(C=C1)C(F)(F)F)=C(O)C
Tpsa: 75.63
Logp: 3.039
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₄F₃NO₄
Molecular Weight:
317.26
Synonyms:
None
SMILES:
O=C(OCC)C(C(=O)NC1=CC=C(C=C1)C(F)(F)F)=C(O)C
Tpsa:
75.63
Logp:
3.039
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₃₂FNO₂Si
Molecular Weight: 425.61
Synonyms: None
SMILES: O([Si](C(C)C)(C(C)C)C(C)C)[C@H]1C=2C(C3=C(C=4C(O3)=C(F)C=CC4)CC1)=CC=CN2
Tpsa: 35.26
Logp: 7.8133
H Acceptors: 3
H Donors: 0
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:
C₂₅H₃₂FNO₂Si
Molecular Weight:
425.61
Synonyms:
None
SMILES:
O([Si](C(C)C)(C(C)C)C(C)C)[C@H]1C=2C(C3=C(C=4C(O3)=C(F)C=CC4)CC1)=CC=CN2
Tpsa:
35.26
Logp:
7.8133
H Acceptors:
3
H Donors:
0
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: C₂₅H₃₃F₂NO₃Si
Molecular Weight: 461.62
Synonyms: None
SMILES: O([Si](C(C)C)(C(C)C)C(C)C)[C@H]1C=2C(C(=O)C(O)(CC1)C3=C(F)C(F)=CC=C3)=CC=CN2
Tpsa: 59.42
Logp: 6.4573
H Acceptors: 4
H Donors: 1
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:
C₂₅H₃₃F₂NO₃Si
Molecular Weight:
461.62
Synonyms:
None
SMILES:
O([Si](C(C)C)(C(C)C)C(C)C)[C@H]1C=2C(C(=O)C(O)(CC1)C3=C(F)C(F)=CC=C3)=CC=CN2
Tpsa:
59.42
Logp:
6.4573
H Acceptors:
4
H Donors:
1
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: C₂₅H₃₂FNO₃Si
Molecular Weight: 441.61
Synonyms: None
SMILES: O=C1C2(C=3C([C@H](O[Si](C(C)C)(C(C)C)C(C)C)CC2)=NC=CC3)OC=4C1=CC=CC4F
Tpsa: 48.42
Logp: 6.7183
H Acceptors: 4
H Donors: 0
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:
C₂₅H₃₂FNO₃Si
Molecular Weight:
441.61
Synonyms:
None
SMILES:
O=C1C2(C=3C([C@H](O[Si](C(C)C)(C(C)C)C(C)C)CC2)=NC=CC3)OC=4C1=CC=CC4F
Tpsa:
48.42
Logp:
6.7183
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
5