CS-0876987
3-(3-Bromo-5-chlorophenyl)-3-oxopropanenitrile
Manufacturer: ChemScene
CAS Number: 1696195-01-3
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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
C₉H₅BrClNO
Molecular Weight
258.50
Synonyms
None
SMILES
C1=C(C=C(C=C1Cl)Br)C(=O)CC#N
Tpsa
40.86
Logp
3.19888
H Acceptors
2
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1696195-01-3 | 3-Bromo-5-chlorobenzoylacetonitrile | A2B Chem | -- |
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: C₉H₅BrClNO
Molecular Weight: 258.50
Synonyms: None
SMILES: C1=C(C=C(C=C1Cl)Br)C(=O)CC#N
Tpsa: 40.86
Logp: 3.19888
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:
C₉H₅BrClNO
Molecular Weight:
258.50
Synonyms:
None
SMILES:
C1=C(C=C(C=C1Cl)Br)C(=O)CC#N
Tpsa:
40.86
Logp:
3.19888
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: C₂₇H₄₄N₂O₅
Molecular Weight: 476.65
Synonyms: None
SMILES: CC(C)(C)OC[C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1.C1CCC(CC1)NC2CCCCC2
Tpsa: 96.89
Logp: 5.4225
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₄₄N₂O₅
Molecular Weight:
476.65
Synonyms:
None
SMILES:
CC(C)(C)OC[C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1.C1CCC(CC1)NC2CCCCC2
Tpsa:
96.89
Logp:
5.4225
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈BrF₂NO
Molecular Weight: 252.06
Synonyms: None
SMILES: C1=C(C=C(C=C1OCC(F)F)Br)N
Tpsa: 35.25
Logp: 2.6752
H Acceptors: 2
H Donors: 1
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:
C₈H₈BrF₂NO
Molecular Weight:
252.06
Synonyms:
None
SMILES:
C1=C(C=C(C=C1OCC(F)F)Br)N
Tpsa:
35.25
Logp:
2.6752
H Acceptors:
2
H Donors:
1
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: C₈H₇ClF₃NO
Molecular Weight: 225.60
Synonyms: None
SMILES: CC(C1=CC=C(C(F)(F)F)N=C1Cl)O
Tpsa: 33.12
Logp: 2.8071
H Acceptors: 2
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:
C₈H₇ClF₃NO
Molecular Weight:
225.60
Synonyms:
None
SMILES:
CC(C1=CC=C(C(F)(F)F)N=C1Cl)O
Tpsa:
33.12
Logp:
2.8071
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1