CS-0915458
Warfarin Impurity 1
Manufacturer: ChemScene
CAS Number: 55901-61-6
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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
C₁₃H₁₄O
Molecular Weight
186.25
Synonyms
None
SMILES
O=C(C=CC=1C=CC=CC1)C=C(C)C
Tpsa
17.07
Logp
3.2351
H Acceptors
1
H Donors
0
Rotatable Bonds
3
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SAFETY INFORMATION
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: C₁₃H₁₄O
Molecular Weight: 186.25
Synonyms: None
SMILES: O=C(C=CC=1C=CC=CC1)C=C(C)C
Tpsa: 17.07
Logp: 3.2351
H Acceptors: 1
H Donors: 0
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:
C₁₃H₁₄O
Molecular Weight:
186.25
Synonyms:
None
SMILES:
O=C(C=CC=1C=CC=CC1)C=C(C)C
Tpsa:
17.07
Logp:
3.2351
H Acceptors:
1
H Donors:
0
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: C₇H₃BrFNO₄
Molecular Weight: 264.01
Synonyms: None
SMILES: O=C(O)C1=C(F)C(Br)=CC=C1N(=O)=O
Tpsa: 80.44
Logp: 2.1946
H Acceptors: 3
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:
C₇H₃BrFNO₄
Molecular Weight:
264.01
Synonyms:
None
SMILES:
O=C(O)C1=C(F)C(Br)=CC=C1N(=O)=O
Tpsa:
80.44
Logp:
2.1946
H Acceptors:
3
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: C₁₅H₁₂N₂O
Molecular Weight: 236.27
Synonyms: None
SMILES: O=C(C=1C=NC=CC1)C2=C(C=C3C=CC=CN32)C
Tpsa: 34.37
Logp: 2.87372
H Acceptors: 3
H Donors: 0
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:
C₁₅H₁₂N₂O
Molecular Weight:
236.27
Synonyms:
None
SMILES:
O=C(C=1C=NC=CC1)C2=C(C=C3C=CC=CN32)C
Tpsa:
34.37
Logp:
2.87372
H Acceptors:
3
H Donors:
0
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: C₁₈H₁₇Cl₂N₃O₄S
Molecular Weight: 442.32
Synonyms: None
SMILES: O=C1N(C(=O)C(NCCC2=CC=C(C=C2)S(=O)(=O)N)C1)C3=CC=C(Cl)C(Cl)=C3
Tpsa: 109.57
Logp: 2.105
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 6
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₇Cl₂N₃O₄S
Molecular Weight:
442.32
Synonyms:
None
SMILES:
O=C1N(C(=O)C(NCCC2=CC=C(C=C2)S(=O)(=O)N)C1)C3=CC=C(Cl)C(Cl)=C3
Tpsa:
109.57
Logp:
2.105
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
6