CS-0609179
4-(6-Nitrobenzo[d][1,3]dioxol-5-yl)but-3-yn-1-ol
Manufacturer: ChemScene
CAS Number: 2535525-16-5
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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
C₁₁H₉NO₅
Molecular Weight
235.19
Synonyms
None
SMILES
OCCC#CC1=C([N+]([O-])=O)C=C(OCO2)C2=C1
Tpsa
81.83
Logp
1.0574
H Acceptors
5
H Donors
1
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 2535525-16-5 | 4-(6-Nitrobenzo[d][1,3]dioxol-5-yl)but-3-yn-1-ol | A2B Chem | -- |
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: C₁₁H₉NO₅
Molecular Weight: 235.19
Synonyms: None
SMILES: OCCC#CC1=C([N+]([O-])=O)C=C(OCO2)C2=C1
Tpsa: 81.83
Logp: 1.0574
H Acceptors: 5
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:
C₁₁H₉NO₅
Molecular Weight:
235.19
Synonyms:
None
SMILES:
OCCC#CC1=C([N+]([O-])=O)C=C(OCO2)C2=C1
Tpsa:
81.83
Logp:
1.0574
H Acceptors:
5
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: C₁₁H₁₂BrClINO₂
Molecular Weight: 432.48
Synonyms: None
SMILES: O=C(NC1=CC(Cl)=C(C(Br)=C1)I)OC(C)(C)C
Tpsa: 38.33
Logp: 5.0541
H Acceptors: 2
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:
C₁₁H₁₂BrClINO₂
Molecular Weight:
432.48
Synonyms:
None
SMILES:
O=C(NC1=CC(Cl)=C(C(Br)=C1)I)OC(C)(C)C
Tpsa:
38.33
Logp:
5.0541
H Acceptors:
2
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: C₈H₅FO
Molecular Weight: 136.12
Synonyms: None
SMILES: OC1=CC=C(C#C)C(F)=C1
Tpsa: 20.23
Logp: 1.5126
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:
C₈H₅FO
Molecular Weight:
136.12
Synonyms:
None
SMILES:
OC1=CC=C(C#C)C(F)=C1
Tpsa:
20.23
Logp:
1.5126
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: C₁₀H₄BrCl₂F₃N₂
Molecular Weight: 359.96
Synonyms: None
SMILES: FC(C1=CC2=C(Cl)N=C(Cl)N=C2C(C)=C1Br)(F)F
Tpsa: 25.78
Logp: 5.02632
H Acceptors: 2
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:
C₁₀H₄BrCl₂F₃N₂
Molecular Weight:
359.96
Synonyms:
None
SMILES:
FC(C1=CC2=C(Cl)N=C(Cl)N=C2C(C)=C1Br)(F)F
Tpsa:
25.78
Logp:
5.02632
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0