CS-0693941
tert-Butyl 2-bromo-6,6-dimethyl-4-oxo-4,6-dihydro-5H-pyrrolo[3,4-d]thiazole-5-carboxylate
Manufacturer: ChemScene
CAS Number: 2883668-01-5
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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
C₁₂H₁₅BrN₂O₃S
Molecular Weight
347.23
Synonyms
None
SMILES
O=C(N(C1(C)C)C(C2=C1SC(Br)=N2)=O)OC(C)(C)C
Tpsa
59.5
Logp
3.5316
H Acceptors
5
H Donors
0
Rotatable Bonds
0
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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: C₁₂H₁₅BrN₂O₃S
Molecular Weight: 347.23
Synonyms: None
SMILES: O=C(N(C1(C)C)C(C2=C1SC(Br)=N2)=O)OC(C)(C)C
Tpsa: 59.5
Logp: 3.5316
H Acceptors: 5
H Donors: 0
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:
C₁₂H₁₅BrN₂O₃S
Molecular Weight:
347.23
Synonyms:
None
SMILES:
O=C(N(C1(C)C)C(C2=C1SC(Br)=N2)=O)OC(C)(C)C
Tpsa:
59.5
Logp:
3.5316
H Acceptors:
5
H Donors:
0
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: C₅H₅NO₅S
Molecular Weight: 191.16
Synonyms: None
SMILES: O=C(C1=CC(S(=O)(N)=O)=CO1)O
Tpsa: 110.6
Logp: -0.3748
H Acceptors: 4
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:
C₅H₅NO₅S
Molecular Weight:
191.16
Synonyms:
None
SMILES:
O=C(C1=CC(S(=O)(N)=O)=CO1)O
Tpsa:
110.6
Logp:
-0.3748
H Acceptors:
4
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: C₅H₂Br₂IN
Molecular Weight: 362.79
Synonyms: None
SMILES: IC1=C(Br)C=CN=C1Br
Tpsa: 12.89
Logp: 3.2112
H Acceptors: 1
H Donors: 0
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:
C₅H₂Br₂IN
Molecular Weight:
362.79
Synonyms:
None
SMILES:
IC1=C(Br)C=CN=C1Br
Tpsa:
12.89
Logp:
3.2112
H Acceptors:
1
H Donors:
0
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: C₈H₉N₃O₂S
Molecular Weight: 211.24
Synonyms: None
SMILES: O=S(C1=CNC2=C1C=C(N)C=C2)(N)=O
Tpsa: 101.97
Logp: 0.3975
H Acceptors: 3
H Donors: 3
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:
C₈H₉N₃O₂S
Molecular Weight:
211.24
Synonyms:
None
SMILES:
O=S(C1=CNC2=C1C=C(N)C=C2)(N)=O
Tpsa:
101.97
Logp:
0.3975
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
1