CS-1002796
Olaparib Impurity 81
Manufacturer: ChemScene
CAS Number: 2231236-77-2
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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
C₁₈H₁₅FN₂O₃
Molecular Weight
326.32
Synonyms
None
SMILES
O=C(OCC)C1=CC(=CC=C1F)CC2=NNC(=O)C=3C=CC=CC32
Tpsa
72.05
Logp
2.8297
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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: C₁₈H₁₅FN₂O₃
Molecular Weight: 326.32
Synonyms: None
SMILES: O=C(OCC)C1=CC(=CC=C1F)CC2=NNC(=O)C=3C=CC=CC32
Tpsa: 72.05
Logp: 2.8297
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:
C₁₈H₁₅FN₂O₃
Molecular Weight:
326.32
Synonyms:
None
SMILES:
O=C(OCC)C1=CC(=CC=C1F)CC2=NNC(=O)C=3C=CC=CC32
Tpsa:
72.05
Logp:
2.8297
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₃NO₅
Molecular Weight: 321.37
Synonyms: None
SMILES: C(OC(C)(C)C)(=O)N1[C@@H]([C@@H](C(O)=O)OC1(C)C)C2=CC=CC=C2
Tpsa: 76.07
Logp: 3.1843
H Acceptors: 4
H Donors: 1
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:
C₁₇H₂₃NO₅
Molecular Weight:
321.37
Synonyms:
None
SMILES:
C(OC(C)(C)C)(=O)N1[C@@H]([C@@H](C(O)=O)OC1(C)C)C2=CC=CC=C2
Tpsa:
76.07
Logp:
3.1843
H Acceptors:
4
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: C₂₀H₂₆I₃N₃O₁₀
Molecular Weight: 849.15
Synonyms: None
SMILES: O=C(NCC(O)CO)C=1C(I)=C(C(=O)NCC(O)CO)C(I)=C(C1I)N(C(=O)COC(=O)C)CCO
Tpsa: 205.96
Logp: -1.4452
H Acceptors: 10
H Donors: 7
Rotatable Bonds: 13
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₆I₃N₃O₁₀
Molecular Weight:
849.15
Synonyms:
None
SMILES:
O=C(NCC(O)CO)C=1C(I)=C(C(=O)NCC(O)CO)C(I)=C(C1I)N(C(=O)COC(=O)C)CCO
Tpsa:
205.96
Logp:
-1.4452
H Acceptors:
10
H Donors:
7
Rotatable Bonds:
13
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₈O
Molecular Weight: 274.36
Synonyms: None
SMILES: OC1=CC=CC(=C1C(C=2C=CC=CC2)C=3C=CC=CC3)C
Tpsa: 20.23
Logp: 4.88082
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₈O
Molecular Weight:
274.36
Synonyms:
None
SMILES:
OC1=CC=CC(=C1C(C=2C=CC=CC2)C=3C=CC=CC3)C
Tpsa:
20.23
Logp:
4.88082
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
3