CS-1002382
Vonoprazan Impurity 128
Manufacturer: ChemScene
CAS Number: 1956309-28-6
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₉FN₂O
Molecular Weight
204.20
Synonyms
None
SMILES
O=C(N)C1=CNC(=C1)C=2C=CC=CC2F
Tpsa
58.88
Logp
1.9197
H Acceptors
1
H Donors
2
Rotatable Bonds
2
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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₉FN₂O
Molecular Weight: 204.20
Synonyms: None
SMILES: O=C(N)C1=CNC(=C1)C=2C=CC=CC2F
Tpsa: 58.88
Logp: 1.9197
H Acceptors: 1
H Donors: 2
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₉FN₂O
Molecular Weight:
204.20
Synonyms:
None
SMILES:
O=C(N)C1=CNC(=C1)C=2C=CC=CC2F
Tpsa:
58.88
Logp:
1.9197
H Acceptors:
1
H Donors:
2
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₈O₃
Molecular Weight: 174.24
Synonyms: None
SMILES: [C@H](CC(OCC)=O)(CCC)CO
Tpsa: 46.53
Logp: 1.3482
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 6
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₈O₃
Molecular Weight:
174.24
Synonyms:
None
SMILES:
[C@H](CC(OCC)=O)(CCC)CO
Tpsa:
46.53
Logp:
1.3482
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₃₀O₅
Molecular Weight: 362.46
Synonyms: None
SMILES: C[C@@]12[C@@]3([C@]([C@]4([C@](C)(C[C@@H]3O)[C@@H](C(C(O)O)=O)CC4)[H])(CCC1=CC(=O)CC2)[H])[H]
Tpsa: 94.83
Logp: 1.9851
H Acceptors: 5
H Donors: 3
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:
C₂₁H₃₀O₅
Molecular Weight:
362.46
Synonyms:
None
SMILES:
C[C@@]12[C@@]3([C@]([C@]4([C@](C)(C[C@@H]3O)[C@@H](C(C(O)O)=O)CC4)[H])(CCC1=CC(=O)CC2)[H])[H]
Tpsa:
94.83
Logp:
1.9851
H Acceptors:
5
H Donors:
3
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: C₁₉H₂₈N₁₀O₈P₂
Molecular Weight: 586.44
Synonyms: None
SMILES: N(COP(CO[C@@H](CN1C=2C(N=C1)=C(N)N=CN2)C)(=O)O)C3=C4C(N(C[C@H](OCP(=O)(O)O)C)C=N4)=NC=N3
Tpsa: 247.77
Logp: 0.7227
H Acceptors: 15
H Donors: 5
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:
C₁₉H₂₈N₁₀O₈P₂
Molecular Weight:
586.44
Synonyms:
None
SMILES:
N(COP(CO[C@@H](CN1C=2C(N=C1)=C(N)N=CN2)C)(=O)O)C3=C4C(N(C[C@H](OCP(=O)(O)O)C)C=N4)=NC=N3
Tpsa:
247.77
Logp:
0.7227
H Acceptors:
15
H Donors:
5
Rotatable Bonds:
14