CS-1000248
Regorafenib Impurity 116
Manufacturer: ChemScene
CAS Number: 103842-00-8
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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
C₈H₈FNO₂
Molecular Weight
169.15
Synonyms
None
SMILES
O=C(NC1=CC=C(O)C=C1F)C
Tpsa
49.33
Logp
1.4897
H Acceptors
2
H Donors
2
Rotatable Bonds
1
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: C₈H₈FNO₂
Molecular Weight: 169.15
Synonyms: None
SMILES: O=C(NC1=CC=C(O)C=C1F)C
Tpsa: 49.33
Logp: 1.4897
H Acceptors: 2
H Donors: 2
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:
C₈H₈FNO₂
Molecular Weight:
169.15
Synonyms:
None
SMILES:
O=C(NC1=CC=C(O)C=C1F)C
Tpsa:
49.33
Logp:
1.4897
H Acceptors:
2
H Donors:
2
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: C₁₁H₁₁ClO₄
Molecular Weight: 242.66
Synonyms: None
SMILES: O=C(O)CC(C=1C=CC=CC1Cl)CC(=O)O
Tpsa: 74.6
Logp: 2.373
H Acceptors: 2
H Donors: 2
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:
C₁₁H₁₁ClO₄
Molecular Weight:
242.66
Synonyms:
None
SMILES:
O=C(O)CC(C=1C=CC=CC1Cl)CC(=O)O
Tpsa:
74.6
Logp:
2.373
H Acceptors:
2
H Donors:
2
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: C₁₅H₂₃N₃O
Molecular Weight: 261.36
Synonyms: None
SMILES: C(C=1C=C(OC/C=C\CN)N=CC1)N2CCCCC2
Tpsa: 51.38
Logp: 1.9612
H Acceptors: 4
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:
C₁₅H₂₃N₃O
Molecular Weight:
261.36
Synonyms:
None
SMILES:
C(C=1C=C(OC/C=C\CN)N=CC1)N2CCCCC2
Tpsa:
51.38
Logp:
1.9612
H Acceptors:
4
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: C₂₃H₁₈O₆
Molecular Weight: 390.39
Synonyms: None
SMILES: O=C1C(OCC=2C=CC=CC2)=C(OC=3C=C(O)C=C(O)C13)C=4C=CC(OC)=CC4
Tpsa: 89.13
Logp: 4.4588
H Acceptors: 6
H Donors: 2
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:
C₂₃H₁₈O₆
Molecular Weight:
390.39
Synonyms:
None
SMILES:
O=C1C(OCC=2C=CC=CC2)=C(OC=3C=C(O)C=C(O)C13)C=4C=CC(OC)=CC4
Tpsa:
89.13
Logp:
4.4588
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
5