CS-0531541
4-((4-Hydroxyphenyl)(pyridin-2-yl)methyl)phenyl acetate Bisacodyl Impurity
Manufacturer: ChemScene
CAS Number: 72901-16-7
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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
C₂₀H₁₇NO₃
Molecular Weight
319.35
Synonyms
Monoacetyl bisacodyl
SMILES
O=C(C)OC1=CC=C(C(C2=CC=C(C=C2)O)C3=NC=CC=C3)C=C1
Tpsa
59.42
Logp
3.8927
H Acceptors
4
H Donors
1
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | Bisacodyl Related Compound C | Supelco | ₹ 89,436.15 | |
 | 72901-16-7 | Phenol, 4-[[4-(acetyloxy)phenyl]-2-pyridinylmethyl]- | A2B Chem | ₹ 95,228.28 |
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₂₀H₁₇NO₃
Molecular Weight: 319.35
Synonyms: Monoacetyl bisacodyl
SMILES: O=C(C)OC1=CC=C(C(C2=CC=C(C=C2)O)C3=NC=CC=C3)C=C1
Tpsa: 59.42
Logp: 3.8927
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₇NO₃
Molecular Weight:
319.35
Synonyms:
Monoacetyl bisacodyl
SMILES:
O=C(C)OC1=CC=C(C(C2=CC=C(C=C2)O)C3=NC=CC=C3)C=C1
Tpsa:
59.42
Logp:
3.8927
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD27966915
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₁₉NO₄
Molecular Weight: 361.39
Synonyms: 2-[(RS)-[4-(Acetyloxy)phenyl](pyridin-2-yl)methyl]phenyl Acetate
SMILES: O=C(C)OC1=CC=C(C(C2=C(OC(C)=O)C=CC=C2)C3=NC=CC=C3)C=C1
Tpsa: 65.49
Logp: 4.1124
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
MFCD27966915
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₁₉NO₄
Molecular Weight:
361.39
Synonyms:
2-[(RS)-[4-(Acetyloxy)phenyl](pyridin-2-yl)methyl]phenyl Acetate
SMILES:
O=C(C)OC1=CC=C(C(C2=C(OC(C)=O)C=CC=C2)C3=NC=CC=C3)C=C1
Tpsa:
65.49
Logp:
4.1124
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₃₈N₂O₄
Molecular Weight: 430.58
Synonyms: None
SMILES: OC(CNC(C)C)COC1=CC=C(CC2=CC=C(C=C2)OCC(CNC(C)C)O)C=C1
Tpsa: 82.98
Logp: 2.7528
H Acceptors: 6
H Donors: 4
Rotatable Bonds: 14
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₈N₂O₄
Molecular Weight:
430.58
Synonyms:
None
SMILES:
OC(CNC(C)C)COC1=CC=C(CC2=CC=C(C=C2)OCC(CNC(C)C)O)C=C1
Tpsa:
82.98
Logp:
2.7528
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
14
Purity: 98%
MDL No: MFCD09033791
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₂N₂O₄
Molecular Weight: 342.39
Synonyms: N-Formyl-N-(2-oxo-2-(1-oxo-3,4-dihydroisoquinolin-2(1H)-yl)ethyl)cyclohexanecarboxamide
SMILES: O=CN(CC(N1C(C2=C(CC1)C=CC=C2)=O)=O)C(C3CCCCC3)=O
Tpsa: 74.76
Logp: 1.7768
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
MFCD09033791
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₂N₂O₄
Molecular Weight:
342.39
Synonyms:
N-Formyl-N-(2-oxo-2-(1-oxo-3,4-dihydroisoquinolin-2(1H)-yl)ethyl)cyclohexanecarboxamide
SMILES:
O=CN(CC(N1C(C2=C(CC1)C=CC=C2)=O)=O)C(C3CCCCC3)=O
Tpsa:
74.76
Logp:
1.7768
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4