CS-0611375
2-(4-Bromo-2-(methylsulfonyl)phenyl)acetic acid
Manufacturer: ChemScene
CAS Number: 1887769-51-8
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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
C₉H₉BrO₄S
Molecular Weight
293.13
Synonyms
None
SMILES
O=C(O)CC1=CC=C(Br)C=C1S(=O)(C)=O
Tpsa
71.44
Logp
1.4797
H Acceptors
3
H Donors
1
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: C₉H₉BrO₄S
Molecular Weight: 293.13
Synonyms: None
SMILES: O=C(O)CC1=CC=C(Br)C=C1S(=O)(C)=O
Tpsa: 71.44
Logp: 1.4797
H Acceptors: 3
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:
C₉H₉BrO₄S
Molecular Weight:
293.13
Synonyms:
None
SMILES:
O=C(O)CC1=CC=C(Br)C=C1S(=O)(C)=O
Tpsa:
71.44
Logp:
1.4797
H Acceptors:
3
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: C₇H₆F₃NO
Molecular Weight: 177.12
Synonyms: None
SMILES: OCC1=CC=C(C(F)F)N=C1F
Tpsa: 33.12
Logp: 1.6506
H Acceptors: 2
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:
C₇H₆F₃NO
Molecular Weight:
177.12
Synonyms:
None
SMILES:
OCC1=CC=C(C(F)F)N=C1F
Tpsa:
33.12
Logp:
1.6506
H Acceptors:
2
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: C₄H₅BrN₂O
Molecular Weight: 177.00
Synonyms: None
SMILES: BrC1=C(C=NN1C)O
Tpsa: 38.05
Logp: 0.8882
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₅BrN₂O
Molecular Weight:
177.00
Synonyms:
None
SMILES:
BrC1=C(C=NN1C)O
Tpsa:
38.05
Logp:
0.8882
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₄BrNO₄
Molecular Weight: 316.15
Synonyms: None
SMILES: COC([C@H](NC(OC)=O)CC1=CC=CC=C1Br)=O
Tpsa: 64.63
Logp: 1.8892
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:
C₁₂H₁₄BrNO₄
Molecular Weight:
316.15
Synonyms:
None
SMILES:
COC([C@H](NC(OC)=O)CC1=CC=CC=C1Br)=O
Tpsa:
64.63
Logp:
1.8892
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4