CS-0590484
(S)-2-(Hydroxy(4-nitrophenyl)methyl)cyclohex-2-en-1-one
Manufacturer: ChemScene
CAS Number: 847667-20-3
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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
C₁₃H₁₃NO₄
Molecular Weight
247.25
Synonyms
None
SMILES
O[C@@H](C1=CC=C(C=C1)[N+]([O-])=O)C2=CCCCC2=O
Tpsa
80.44
Logp
2.3076
H Acceptors
4
H Donors
1
Rotatable Bonds
3
Related Products
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: C₁₃H₁₃NO₄
Molecular Weight: 247.25
Synonyms: None
SMILES: O[C@@H](C1=CC=C(C=C1)[N+]([O-])=O)C2=CCCCC2=O
Tpsa: 80.44
Logp: 2.3076
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:
C₁₃H₁₃NO₄
Molecular Weight:
247.25
Synonyms:
None
SMILES:
O[C@@H](C1=CC=C(C=C1)[N+]([O-])=O)C2=CCCCC2=O
Tpsa:
80.44
Logp:
2.3076
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: C₁₁H₁₀O₄
Molecular Weight: 206.19
Synonyms: Ethyl 7-Hydroxy-1-benzofuran-5-carboxylate
SMILES: O=C(C1=CC(O)=C(OC=C2)C2=C1)OCC
Tpsa: 59.67
Logp: 2.3151
H Acceptors: 4
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:
C₁₁H₁₀O₄
Molecular Weight:
206.19
Synonyms:
Ethyl 7-Hydroxy-1-benzofuran-5-carboxylate
SMILES:
O=C(C1=CC(O)=C(OC=C2)C2=C1)OCC
Tpsa:
59.67
Logp:
2.3151
H Acceptors:
4
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: C₁₀H₁₇NO₂
Molecular Weight: 183.25
Synonyms: None
SMILES: O=C([C@@H]1[C@@](C2)([H])CC[C@@]2([H])[C@@H]1N)OCC
Tpsa: 52.32
Logp: 0.9229
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:
C₁₀H₁₇NO₂
Molecular Weight:
183.25
Synonyms:
None
SMILES:
O=C([C@@H]1[C@@](C2)([H])CC[C@@]2([H])[C@@H]1N)OCC
Tpsa:
52.32
Logp:
0.9229
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: C₇H₂F₂IN
Molecular Weight: 265.00
Synonyms: None
SMILES: N#CC1=CC=C(F)C(F)=C1I
Tpsa: 23.79
Logp: 2.44108
H Acceptors: 1
H Donors: 0
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:
C₇H₂F₂IN
Molecular Weight:
265.00
Synonyms:
None
SMILES:
N#CC1=CC=C(F)C(F)=C1I
Tpsa:
23.79
Logp:
2.44108
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0