CS-0775613
3-Bromo-4-(methylsulfonyl)benzonitrile
Manufacturer: ChemScene
CAS Number: 1379363-31-1
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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
C₈H₆BrNO₂S
Molecular Weight
260.11
Synonyms
None
SMILES
N#CC1=CC=C(S(=O)(C)=O)C(Br)=C1
Tpsa
57.93
Logp
1.72428
H Acceptors
3
H Donors
0
Rotatable Bonds
1
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: C₈H₆BrNO₂S
Molecular Weight: 260.11
Synonyms: None
SMILES: N#CC1=CC=C(S(=O)(C)=O)C(Br)=C1
Tpsa: 57.93
Logp: 1.72428
H Acceptors: 3
H Donors: 0
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:
C₈H₆BrNO₂S
Molecular Weight:
260.11
Synonyms:
None
SMILES:
N#CC1=CC=C(S(=O)(C)=O)C(Br)=C1
Tpsa:
57.93
Logp:
1.72428
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: 4°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₆O₂Si
Molecular Weight: 148.28
Synonyms: None
SMILES: O[Si](C(C)C)(C(C)C)O
Tpsa: 40.46
Logp: 1.2332
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
4°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₆O₂Si
Molecular Weight:
148.28
Synonyms:
None
SMILES:
O[Si](C(C)C)(C(C)C)O
Tpsa:
40.46
Logp:
1.2332
H Acceptors:
2
H Donors:
2
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: C₁₁H₉FO₃
Molecular Weight: 208.19
Synonyms: None
SMILES: OC([C@@H]1[C@]2(C1)C3=CC(F)=CC=C3OC2)=O
Tpsa: 46.53
Logp: 1.5604
H Acceptors: 2
H Donors: 1
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:
C₁₁H₉FO₃
Molecular Weight:
208.19
Synonyms:
None
SMILES:
OC([C@@H]1[C@]2(C1)C3=CC(F)=CC=C3OC2)=O
Tpsa:
46.53
Logp:
1.5604
H Acceptors:
2
H Donors:
1
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: C₁₃H₁₁FN₂O₅S
Molecular Weight: 326.30
Synonyms: None
SMILES: O=S(C1=CC2=C(CN(C(CC3)C(NC3=O)=O)C2=O)C=C1)(F)=O
Tpsa: 100.62
Logp: 0.1058
H Acceptors: 5
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:
C₁₃H₁₁FN₂O₅S
Molecular Weight:
326.30
Synonyms:
None
SMILES:
O=S(C1=CC2=C(CN(C(CC3)C(NC3=O)=O)C2=O)C=C1)(F)=O
Tpsa:
100.62
Logp:
0.1058
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2