CS-0375077
1-Amino-6-bromobenzo[d]isothiazol-3-one 1-oxide
Manufacturer: ChemScene
CAS Number: 2422988-95-0
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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
C₇H₅BrN₂O₂S
Molecular Weight
261.10
Synonyms
3H-1λ4-1,2-Benzisothiazol-3-one, 1-amino-6-bromo-, 1-oxide
SMILES
O=C1N=S(N)(C2=C1C=CC(Br)=C2)=O
Tpsa
72.52
Logp
1.3035
H Acceptors
2
H Donors
1
Rotatable Bonds
0
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: C₇H₅BrN₂O₂S
Molecular Weight: 261.10
Synonyms: 3H-1λ4-1,2-Benzisothiazol-3-one, 1-amino-6-bromo-, 1-oxide
SMILES: O=C1N=S(N)(C2=C1C=CC(Br)=C2)=O
Tpsa: 72.52
Logp: 1.3035
H Acceptors: 2
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:
C₇H₅BrN₂O₂S
Molecular Weight:
261.10
Synonyms:
3H-1λ4-1,2-Benzisothiazol-3-one, 1-amino-6-bromo-, 1-oxide
SMILES:
O=C1N=S(N)(C2=C1C=CC(Br)=C2)=O
Tpsa:
72.52
Logp:
1.3035
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 97%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₉NO₄
Molecular Weight: 337.37
Synonyms: (1R,2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}cyclobutanecarboxylic acid
SMILES: O=C([C@H]1[C@@H](NC(OCC2C3=C(C4=C2C=CC=C4)C=CC=C3)=O)CC1)O
Tpsa: 75.63
Logp: 3.3883
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₉NO₄
Molecular Weight:
337.37
Synonyms:
(1R,2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}cyclobutanecarboxylic acid
SMILES:
O=C([C@H]1[C@@H](NC(OCC2C3=C(C4=C2C=CC=C4)C=CC=C3)=O)CC1)O
Tpsa:
75.63
Logp:
3.3883
H Acceptors:
3
H Donors:
2
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: C₈H₁₃F₂NO
Molecular Weight: 177.19
Synonyms: None
SMILES: OCC12CC(F)CN1CC(F)C2
Tpsa: 23.47
Logp: 0.5031
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:
C₈H₁₃F₂NO
Molecular Weight:
177.19
Synonyms:
None
SMILES:
OCC12CC(F)CN1CC(F)C2
Tpsa:
23.47
Logp:
0.5031
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: C₅H₈FNO₂
Molecular Weight: 133.12
Synonyms: None
SMILES: O=C(OC)/C=C(N)/CF
Tpsa: 52.32
Logp: -0.0285
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:
C₅H₈FNO₂
Molecular Weight:
133.12
Synonyms:
None
SMILES:
O=C(OC)/C=C(N)/CF
Tpsa:
52.32
Logp:
-0.0285
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2