CS-1013127
2,4-Diazabicyclo[4.2.0]octa-1,3,5-triene, 5-bromo-3-(methylsulfonyl)-
Manufacturer: ChemScene
CAS Number: 3020009-49-5
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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
C₇H₇BrN₂O₂S
Molecular Weight
263.11
Synonyms
None
SMILES
O=S(C1=NC(Br)=C2CCC2=N1)(C)=O
Tpsa
59.92
Logp
0.7412
H Acceptors
4
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: C₇H₇BrN₂O₂S
Molecular Weight: 263.11
Synonyms: None
SMILES: O=S(C1=NC(Br)=C2CCC2=N1)(C)=O
Tpsa: 59.92
Logp: 0.7412
H Acceptors: 4
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:
C₇H₇BrN₂O₂S
Molecular Weight:
263.11
Synonyms:
None
SMILES:
O=S(C1=NC(Br)=C2CCC2=N1)(C)=O
Tpsa:
59.92
Logp:
0.7412
H Acceptors:
4
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: C₈H₉F₃OS
Molecular Weight: 210.22
Synonyms: None
SMILES: OC(C)(C)C1=CC=C(C(F)(F)F)S1
Tpsa: 20.23
Logp: 2.9943
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:
C₈H₉F₃OS
Molecular Weight:
210.22
Synonyms:
None
SMILES:
OC(C)(C)C1=CC=C(C(F)(F)F)S1
Tpsa:
20.23
Logp:
2.9943
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: C₇H₁₁NO₂
Molecular Weight: 141.17
Synonyms: None
SMILES: O=C1NC2(C(C1)O)CCC2
Tpsa: 49.33
Logp: -0.2101
H Acceptors: 2
H Donors: 2
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:
C₇H₁₁NO₂
Molecular Weight:
141.17
Synonyms:
None
SMILES:
O=C1NC2(C(C1)O)CCC2
Tpsa:
49.33
Logp:
-0.2101
H Acceptors:
2
H Donors:
2
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: C₈H₆F₂O₄S
Molecular Weight: 236.19
Synonyms: None
SMILES: O=C(O)C(F)(F)C1=CC=C(C(OC)=O)S1
Tpsa: 63.6
Logp: 1.7111
H Acceptors: 4
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:
C₈H₆F₂O₄S
Molecular Weight:
236.19
Synonyms:
None
SMILES:
O=C(O)C(F)(F)C1=CC=C(C(OC)=O)S1
Tpsa:
63.6
Logp:
1.7111
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3