CS-0786203
6-Cyano-trans-3-bromo-3,4-dihydro-2,2-dimethyl-2H-benzo-[b]-pyran-4-ol
Manufacturer: ChemScene
CAS Number: 65018-89-5
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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
C₁₂H₁₂BrNO₂
Molecular Weight
282.13
Synonyms
None
SMILES
O[C@@H]1[C@@H](Br)C(C)(C)OC2=C1C=C(C#N)C=C2
Tpsa
53.25
Logp
2.52618
H Acceptors
3
H Donors
1
Rotatable Bonds
0
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 65018-89-5 | 6-Cyano-trans-3-bromo-3,4-dihydro-2,2-dimethyl-2H-benzo-[b]-pyran-4-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: C₁₂H₁₂BrNO₂
Molecular Weight: 282.13
Synonyms: None
SMILES: O[C@@H]1[C@@H](Br)C(C)(C)OC2=C1C=C(C#N)C=C2
Tpsa: 53.25
Logp: 2.52618
H Acceptors: 3
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:
C₁₂H₁₂BrNO₂
Molecular Weight:
282.13
Synonyms:
None
SMILES:
O[C@@H]1[C@@H](Br)C(C)(C)OC2=C1C=C(C#N)C=C2
Tpsa:
53.25
Logp:
2.52618
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₅N₃O
Molecular Weight: 217.27
Synonyms: None
SMILES: NC1=CC2=C(NC=C2CCNC(C)=O)C=C1
Tpsa: 70.91
Logp: 1.4287
H Acceptors: 2
H Donors: 3
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₅N₃O
Molecular Weight:
217.27
Synonyms:
None
SMILES:
NC1=CC2=C(NC=C2CCNC(C)=O)C=C1
Tpsa:
70.91
Logp:
1.4287
H Acceptors:
2
H Donors:
3
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₃NO₂
Molecular Weight: 321.41
Synonyms: None
SMILES: O=C(O)C(C)(C)C#C/C=C/CN(C)CC1=C(C=CC=C2)C2=CC=C1
Tpsa: 40.54
Logp: 3.942
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₃NO₂
Molecular Weight:
321.41
Synonyms:
None
SMILES:
O=C(O)C(C)(C)C#C/C=C/CN(C)CC1=C(C=CC=C2)C2=CC=C1
Tpsa:
40.54
Logp:
3.942
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₁FO₅
Molecular Weight: 182.15
Synonyms: None
SMILES: F[C@@H]1[C@H](O)[C@@H](O)C(O)O[C@@H]1CO
Tpsa: 90.15
Logp: -2.2442
H Acceptors: 5
H Donors: 4
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₁FO₅
Molecular Weight:
182.15
Synonyms:
None
SMILES:
F[C@@H]1[C@H](O)[C@@H](O)C(O)O[C@@H]1CO
Tpsa:
90.15
Logp:
-2.2442
H Acceptors:
5
H Donors:
4
Rotatable Bonds:
1