CS-0142183
3-(4-Hydroxypiperidin-1-yl)benzonitrile
Manufacturer: ChemScene
CAS Number: 891854-14-1
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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
C₁₂H₁₄N₂O
Molecular Weight
202.25
Synonyms
3-(4-Hydroxy-piperidin-1-yl)-benzonitrile
SMILES
OC(CC1)CCN1C2=CC(C#N)=CC=C2
Tpsa
47.26
Logp
1.51938
H Acceptors
3
H Donors
1
Rotatable Bonds
1
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₁₂H₁₄N₂O
Molecular Weight: 202.25
Synonyms: 3-(4-Hydroxy-piperidin-1-yl)-benzonitrile
SMILES: OC(CC1)CCN1C2=CC(C#N)=CC=C2
Tpsa: 47.26
Logp: 1.51938
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:
C₁₂H₁₄N₂O
Molecular Weight:
202.25
Synonyms:
3-(4-Hydroxy-piperidin-1-yl)-benzonitrile
SMILES:
OC(CC1)CCN1C2=CC(C#N)=CC=C2
Tpsa:
47.26
Logp:
1.51938
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD00078417
Storage: 4°C, sealed storage, away from moisture and light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₃N₄NaO₆S₂
Molecular Weight: 492.46
Synonyms: None
SMILES: O=S(C1=CC=C(C2=NC(C3=NC=CC=C3)=NN=C2C4=CC=C(S(=O)(O[Na])=O)C=C4)C=C1)(O)=O
Tpsa: 149.3
Logp: 2.3031
H Acceptors: 9
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
MFCD00078417
Storage:
4°C, sealed storage, away from moisture and light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₃N₄NaO₆S₂
Molecular Weight:
492.46
Synonyms:
None
SMILES:
O=S(C1=CC=C(C2=NC(C3=NC=CC=C3)=NN=C2C4=CC=C(S(=O)(O[Na])=O)C=C4)C=C1)(O)=O
Tpsa:
149.3
Logp:
2.3031
H Acceptors:
9
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: MFCD11846307
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₅BrFN
Molecular Weight: 226.05
Synonyms: None
SMILES: FC1=CC=C(Br)C2=C1C=CN=C2
Tpsa: 12.89
Logp: 3.1364
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD11846307
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₅BrFN
Molecular Weight:
226.05
Synonyms:
None
SMILES:
FC1=CC=C(Br)C2=C1C=CN=C2
Tpsa:
12.89
Logp:
3.1364
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: 4°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₇N₃NaO₁₀P
Molecular Weight: 465.28
Synonyms: None
SMILES: O=C(N1)N([C@@H]2O[C@H](COP(OC3=CC=C([N+]([O-])=O)C=C3)(O[Na])=O)[C@@H](O)C2)C=C(C)C1=O
Tpsa: 172.22
Logp: 0.70542
H Acceptors: 11
H Donors: 2
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
4°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₇N₃NaO₁₀P
Molecular Weight:
465.28
Synonyms:
None
SMILES:
O=C(N1)N([C@@H]2O[C@H](COP(OC3=CC=C([N+]([O-])=O)C=C3)(O[Na])=O)[C@@H](O)C2)C=C(C)C1=O
Tpsa:
172.22
Logp:
0.70542
H Acceptors:
11
H Donors:
2
Rotatable Bonds:
8