CS-0900583
4-Bromo-2-methyl-7-nitroisoquinolin-1(2H)-one
Manufacturer: ChemScene
CAS Number: 54931-65-6
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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
C₁₀H₇BrN₂O₃
Molecular Weight
283.08
Synonyms
None
SMILES
O=C1C2=C(C(Br)=CN1C)C=CC([N+]([O-])=O)=C2
Tpsa
65.14
Logp
2.2092
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: C₁₀H₇BrN₂O₃
Molecular Weight: 283.08
Synonyms: None
SMILES: O=C1C2=C(C(Br)=CN1C)C=CC([N+]([O-])=O)=C2
Tpsa: 65.14
Logp: 2.2092
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:
C₁₀H₇BrN₂O₃
Molecular Weight:
283.08
Synonyms:
None
SMILES:
O=C1C2=C(C(Br)=CN1C)C=CC([N+]([O-])=O)=C2
Tpsa:
65.14
Logp:
2.2092
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: C₁₄H₁₁BrN₂
Molecular Weight: 287.15
Synonyms: None
SMILES: BrC1=CC2=NN(CC3=CC=CC=C3)C=C2C=C1
Tpsa: 17.82
Logp: 3.8471
H Acceptors: 2
H Donors: 0
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:
C₁₄H₁₁BrN₂
Molecular Weight:
287.15
Synonyms:
None
SMILES:
BrC1=CC2=NN(CC3=CC=CC=C3)C=C2C=C1
Tpsa:
17.82
Logp:
3.8471
H Acceptors:
2
H Donors:
0
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: C₂₀H₂₁BrN₂O₅S
Molecular Weight: 481.36
Synonyms: None
SMILES: CN1C=C(C2=C(C1=O)N(S(C3=CC=C(C=C3)C)(=O)=O)C(C(OCC(C)C)=O)=C2)Br
Tpsa: 87.37
Logp: 3.46072
H Acceptors: 7
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₁BrN₂O₅S
Molecular Weight:
481.36
Synonyms:
None
SMILES:
CN1C=C(C2=C(C1=O)N(S(C3=CC=C(C=C3)C)(=O)=O)C(C(OCC(C)C)=O)=C2)Br
Tpsa:
87.37
Logp:
3.46072
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₇BrINO₂
Molecular Weight: 343.94
Synonyms: None
SMILES: O=C1C(I)=C(C(Br)=CN1C)OC
Tpsa: 31.23
Logp: 1.761
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:
C₇H₇BrINO₂
Molecular Weight:
343.94
Synonyms:
None
SMILES:
O=C1C(I)=C(C(Br)=CN1C)OC
Tpsa:
31.23
Logp:
1.761
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1