CS-0514416
3-(2-Bromo-5-iodophenyl)propanenitrile
Manufacturer: ChemScene
CAS Number: 1806586-27-5
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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
C₉H₇BrIN
Molecular Weight
335.97
Synonyms
None
SMILES
N#CCCC1=CC(I)=CC=C1Br
Tpsa
23.79
Logp
3.50988
H Acceptors
1
H Donors
0
Rotatable Bonds
2
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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: C₉H₇BrIN
Molecular Weight: 335.97
Synonyms: None
SMILES: N#CCCC1=CC(I)=CC=C1Br
Tpsa: 23.79
Logp: 3.50988
H Acceptors: 1
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:
C₉H₇BrIN
Molecular Weight:
335.97
Synonyms:
None
SMILES:
N#CCCC1=CC(I)=CC=C1Br
Tpsa:
23.79
Logp:
3.50988
H Acceptors:
1
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: C₁₁H₁₂BrIO₂
Molecular Weight: 383.02
Synonyms: None
SMILES: O=C(OCC)CCC1=CC(I)=CC=C1Br
Tpsa: 26.3
Logp: 3.5494
H Acceptors: 2
H Donors: 0
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:
C₁₁H₁₂BrIO₂
Molecular Weight:
383.02
Synonyms:
None
SMILES:
O=C(OCC)CCC1=CC(I)=CC=C1Br
Tpsa:
26.3
Logp:
3.5494
H Acceptors:
2
H Donors:
0
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: C₆H₇ClN₂S
Molecular Weight: 174.65
Synonyms: None
SMILES: CSC1=C(Cl)C(C)=NC=N1
Tpsa: 25.78
Logp: 2.16032
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:
C₆H₇ClN₂S
Molecular Weight:
174.65
Synonyms:
None
SMILES:
CSC1=C(Cl)C(C)=NC=N1
Tpsa:
25.78
Logp:
2.16032
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: C₉H₈BrIO₂
Molecular Weight: 354.97
Synonyms: Benzeneacetic acid, 2-bromo-5-iodo-, methyl ester
SMILES: O=C(OC)CC1=CC(I)=CC=C1Br
Tpsa: 26.3
Logp: 2.7692
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:
C₉H₈BrIO₂
Molecular Weight:
354.97
Synonyms:
Benzeneacetic acid, 2-bromo-5-iodo-, methyl ester
SMILES:
O=C(OC)CC1=CC(I)=CC=C1Br
Tpsa:
26.3
Logp:
2.7692
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2