CS-0626302
tert-Butyl 4-(2-fluorophenyl)-3-oxobutanoate
Manufacturer: ChemScene
CAS Number: 2773311-32-1
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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
C₁₄H₁₇FO₃
Molecular Weight
252.28
Synonyms
None
SMILES
O=C(OC(C)(C)C)CC(CC1=CC=CC=C1F)=O
Tpsa
43.37
Logp
2.6691
H Acceptors
3
H Donors
0
Rotatable Bonds
4
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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: C₁₄H₁₇FO₃
Molecular Weight: 252.28
Synonyms: None
SMILES: O=C(OC(C)(C)C)CC(CC1=CC=CC=C1F)=O
Tpsa: 43.37
Logp: 2.6691
H Acceptors: 3
H Donors: 0
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:
C₁₄H₁₇FO₃
Molecular Weight:
252.28
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)CC(CC1=CC=CC=C1F)=O
Tpsa:
43.37
Logp:
2.6691
H Acceptors:
3
H Donors:
0
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: C₄₅H₆₉N₁₁O₁₂
Molecular Weight: 956.10
Synonyms: None
SMILES: O=C([C@H]1NC([C@@H](NC([C@@H](NC([C@](NC([C@@H](NC(CCCCC1)=O)CC2=CC=C(C=C2)O)=O)([H])[C@@H](C)CC)=O)CCC(N)=O)=O)CC(N)=O)=O)N3[C@@H](CCC3)C(N[C@@H](CC(C)C)C(NCC(N)=O)=O)=O
Tpsa: 373.51
Logp: -2.3668
H Acceptors: 12
H Donors: 11
Rotatable Bonds: 17
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₅H₆₉N₁₁O₁₂
Molecular Weight:
956.10
Synonyms:
None
SMILES:
O=C([C@H]1NC([C@@H](NC([C@@H](NC([C@](NC([C@@H](NC(CCCCC1)=O)CC2=CC=C(C=C2)O)=O)([H])[C@@H](C)CC)=O)CCC(N)=O)=O)CC(N)=O)=O)N3[C@@H](CCC3)C(N[C@@H](CC(C)C)C(NCC(N)=O)=O)=O
Tpsa:
373.51
Logp:
-2.3668
H Acceptors:
12
H Donors:
11
Rotatable Bonds:
17
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₀F₃N₃O
Molecular Weight: 221.18
Synonyms: None
SMILES: N#CC[C@@H]1N(C(C(F)(F)F)=O)CCNC1
Tpsa: 56.13
Logp: 0.26278
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:
C₈H₁₀F₃N₃O
Molecular Weight:
221.18
Synonyms:
None
SMILES:
N#CC[C@@H]1N(C(C(F)(F)F)=O)CCNC1
Tpsa:
56.13
Logp:
0.26278
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: C₁₁H₁₃FO₂
Molecular Weight: 196.22
Synonyms: None
SMILES: OC1=CC(F)=C2C(CCC(C)(C)O2)=C1
Tpsa: 29.46
Logp: 2.6349
H Acceptors: 2
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:
C₁₁H₁₃FO₂
Molecular Weight:
196.22
Synonyms:
None
SMILES:
OC1=CC(F)=C2C(CCC(C)(C)O2)=C1
Tpsa:
29.46
Logp:
2.6349
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0