CS-0497034
3-Bromo-5-(cyanomethyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1379366-55-8
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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
C₉H₆BrNO₂
Molecular Weight
240.05
Synonyms
None
SMILES
OC(=O)C1=CC(Br)=CC(CC#N)=C1
Tpsa
61.09
Logp
2.21338
H Acceptors
2
H Donors
1
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1379366-55-8 | Benzoic acid, 3-bromo-5-(cyanomethyl)- | A2B Chem | -- |
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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: C₉H₆BrNO₂
Molecular Weight: 240.05
Synonyms: None
SMILES: OC(=O)C1=CC(Br)=CC(CC#N)=C1
Tpsa: 61.09
Logp: 2.21338
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:
C₉H₆BrNO₂
Molecular Weight:
240.05
Synonyms:
None
SMILES:
OC(=O)C1=CC(Br)=CC(CC#N)=C1
Tpsa:
61.09
Logp:
2.21338
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: C₉H₉ClN₂O₂S
Molecular Weight: 244.70
Synonyms: None
SMILES: CCS(=O)(=O)C1=CNC2=C1N=C(Cl)C=C2
Tpsa: 62.82
Logp: 2.0099
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:
C₉H₉ClN₂O₂S
Molecular Weight:
244.70
Synonyms:
None
SMILES:
CCS(=O)(=O)C1=CNC2=C1N=C(Cl)C=C2
Tpsa:
62.82
Logp:
2.0099
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: C₉H₉ClN₂
Molecular Weight: 180.63
Synonyms: None
SMILES: CCC1=CNC2=C1N=C(Cl)C=C2
Tpsa: 28.68
Logp: 2.7787
H Acceptors: 1
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:
C₉H₉ClN₂
Molecular Weight:
180.63
Synonyms:
None
SMILES:
CCC1=CNC2=C1N=C(Cl)C=C2
Tpsa:
28.68
Logp:
2.7787
H Acceptors:
1
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: C₃H₄ClN₃
Molecular Weight: 117.54
Synonyms: 5-chloro-1H-imidazol-2-amine hydrochloride
SMILES: NC1=NC=C(Cl)N1
Tpsa: 54.7
Logp: 0.6453
H Acceptors: 2
H Donors: 2
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:
C₃H₄ClN₃
Molecular Weight:
117.54
Synonyms:
5-chloro-1H-imidazol-2-amine hydrochloride
SMILES:
NC1=NC=C(Cl)N1
Tpsa:
54.7
Logp:
0.6453
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
0