CS-1100968
2-Bromo-5-(cyanomethyl)benzonitrile
Manufacturer: ChemScene
CAS Number: 1261474-25-2
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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
C₉H₅BrN₂
Molecular Weight
221.05
Synonyms
None
SMILES
N#CCC1=CC=C(Br)C(C#N)=C1
Tpsa
47.58
Logp
2.38686
H Acceptors
2
H Donors
0
Rotatable Bonds
1
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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: C₉H₅BrN₂
Molecular Weight: 221.05
Synonyms: None
SMILES: N#CCC1=CC=C(Br)C(C#N)=C1
Tpsa: 47.58
Logp: 2.38686
H Acceptors: 2
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:
C₉H₅BrN₂
Molecular Weight:
221.05
Synonyms:
None
SMILES:
N#CCC1=CC=C(Br)C(C#N)=C1
Tpsa:
47.58
Logp:
2.38686
H Acceptors:
2
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: C₉H₁₆O₃
Molecular Weight: 172.22
Synonyms: None
SMILES: O=C(O)CC1(COC)CCCC1
Tpsa: 46.53
Logp: 1.6679
H Acceptors: 2
H Donors: 1
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:
C₉H₁₆O₃
Molecular Weight:
172.22
Synonyms:
None
SMILES:
O=C(O)CC1(COC)CCCC1
Tpsa:
46.53
Logp:
1.6679
H Acceptors:
2
H Donors:
1
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: C₁₂H₉BrN₂O₂
Molecular Weight: 293.12
Synonyms: None
SMILES: N#CC1=CC(C(CC2)C(NC2=O)=O)=CC=C1Br
Tpsa: 69.96
Logp: 1.84098
H Acceptors: 3
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:
C₁₂H₉BrN₂O₂
Molecular Weight:
293.12
Synonyms:
None
SMILES:
N#CC1=CC(C(CC2)C(NC2=O)=O)=CC=C1Br
Tpsa:
69.96
Logp:
1.84098
H Acceptors:
3
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: C₇H₄F₃NO₂
Molecular Weight: 191.11
Synonyms: None
SMILES: O=C(O)C(F)(F)C1=CC=C(F)N=C1
Tpsa: 50.19
Logp: 1.3971
H Acceptors: 2
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:
C₇H₄F₃NO₂
Molecular Weight:
191.11
Synonyms:
None
SMILES:
O=C(O)C(F)(F)C1=CC=C(F)N=C1
Tpsa:
50.19
Logp:
1.3971
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2