CS-0628459
Dimethyl 4-bromo-5-cyanophthalate
Manufacturer: ChemScene
CAS Number: 2616552-11-3
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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
C₁₁H₈BrNO₄
Molecular Weight
298.09
Synonyms
None
SMILES
O=C(C1=CC(C#N)=C(Br)C=C1C(OC)=O)OC
Tpsa
76.39
Logp
1.89398
H Acceptors
5
H Donors
0
Rotatable Bonds
2
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: C₁₁H₈BrNO₄
Molecular Weight: 298.09
Synonyms: None
SMILES: O=C(C1=CC(C#N)=C(Br)C=C1C(OC)=O)OC
Tpsa: 76.39
Logp: 1.89398
H Acceptors: 5
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:
C₁₁H₈BrNO₄
Molecular Weight:
298.09
Synonyms:
None
SMILES:
O=C(C1=CC(C#N)=C(Br)C=C1C(OC)=O)OC
Tpsa:
76.39
Logp:
1.89398
H Acceptors:
5
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: C₁₅H₁₉NO
Molecular Weight: 229.32
Synonyms: None
SMILES: O=C1C[C@@H]2N([C@H](C)C3=CC=CC=C3)[C@H](C1)CC2
Tpsa: 20.31
Logp: 2.9435
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:
C₁₅H₁₉NO
Molecular Weight:
229.32
Synonyms:
None
SMILES:
O=C1C[C@@H]2N([C@H](C)C3=CC=CC=C3)[C@H](C1)CC2
Tpsa:
20.31
Logp:
2.9435
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD13189956
Storage: -20°C, protect from light, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₇ClN₂O₄
Molecular Weight: 230.61
Synonyms: None
SMILES: O=C(C1=NC=C([N+]([O-])=O)C(Cl)=C1)OCC
Tpsa: 82.33
Logp: 1.8199
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD13189956
Storage:
-20°C, protect from light, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇ClN₂O₄
Molecular Weight:
230.61
Synonyms:
None
SMILES:
O=C(C1=NC=C([N+]([O-])=O)C(Cl)=C1)OCC
Tpsa:
82.33
Logp:
1.8199
H Acceptors:
5
H Donors:
0
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: C₅H₃ClFNO
Molecular Weight: 147.53
Synonyms: None
SMILES: O=C1C=C(Cl)C(F)=CN1
Tpsa: 32.86
Logp: 1.1674
H Acceptors: 1
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:
C₅H₃ClFNO
Molecular Weight:
147.53
Synonyms:
None
SMILES:
O=C1C=C(Cl)C(F)=CN1
Tpsa:
32.86
Logp:
1.1674
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0