CS-0574320
4-Oxo-4-(3-phenylpropoxy)butanoic acid
Manufacturer: ChemScene
CAS Number: 819802-21-6
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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
C₁₃H₁₆O₄
Molecular Weight
236.26
Synonyms
None
SMILES
O=C(O)CCC(OCCCC1=CC=CC=C1)=O
Tpsa
63.6
Logp
2.0272
H Acceptors
3
H Donors
1
Rotatable Bonds
7
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: C₁₃H₁₆O₄
Molecular Weight: 236.26
Synonyms: None
SMILES: O=C(O)CCC(OCCCC1=CC=CC=C1)=O
Tpsa: 63.6
Logp: 2.0272
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₆O₄
Molecular Weight:
236.26
Synonyms:
None
SMILES:
O=C(O)CCC(OCCCC1=CC=CC=C1)=O
Tpsa:
63.6
Logp:
2.0272
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₁N₃O₅
Molecular Weight: 299.32
Synonyms: 4-[2-[2-(cyclohexanecarbonylamino)acetyl]hydrazinyl]-4-oxobutanoic acid
SMILES: O=C(O)CCC(NNC(CNC(C1CCCCC1)=O)=O)=O
Tpsa: 124.6
Logp: -0.3049
H Acceptors: 4
H Donors: 4
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:
C₁₃H₂₁N₃O₅
Molecular Weight:
299.32
Synonyms:
4-[2-[2-(cyclohexanecarbonylamino)acetyl]hydrazinyl]-4-oxobutanoic acid
SMILES:
O=C(O)CCC(NNC(CNC(C1CCCCC1)=O)=O)=O
Tpsa:
124.6
Logp:
-0.3049
H Acceptors:
4
H Donors:
4
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: C₁₇H₂₃F₃N₂O₂
Molecular Weight: 344.37
Synonyms: 1-Boc-3-(4-trifluoromethyl-phenylamino)-piperidine
SMILES: CC(C)(C)OC(=O)N1CCCC(C1)NC2=CC=C(C=C2)C(F)(F)F
Tpsa: 41.57
Logp: 4.5168
H Acceptors: 3
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:
C₁₇H₂₃F₃N₂O₂
Molecular Weight:
344.37
Synonyms:
1-Boc-3-(4-trifluoromethyl-phenylamino)-piperidine
SMILES:
CC(C)(C)OC(=O)N1CCCC(C1)NC2=CC=C(C=C2)C(F)(F)F
Tpsa:
41.57
Logp:
4.5168
H Acceptors:
3
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: C₈H₆ClF₃
Molecular Weight: 194.58
Synonyms: 2-(4-Chlorophenyl)-1,1,1-trifluoroethane
SMILES: C1=CC(=CC=C1CC(F)(F)F)Cl
Tpsa: 0
Logp: 3.4448
H Acceptors: 0
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:
C₈H₆ClF₃
Molecular Weight:
194.58
Synonyms:
2-(4-Chlorophenyl)-1,1,1-trifluoroethane
SMILES:
C1=CC(=CC=C1CC(F)(F)F)Cl
Tpsa:
0
Logp:
3.4448
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
1