CS-1012251
4-Chloro-3-fluoro-2-iodo-6-(pyrrolidin-1-yl)benzonitrile
Manufacturer: ChemScene
CAS Number: 3028826-83-4
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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
C₁₁H₉ClFIN₂
Molecular Weight
350.56
Synonyms
None
SMILES
N#CC1=C(I)C(F)=C(Cl)C=C1N2CCCC2
Tpsa
27.03
Logp
3.55558
H Acceptors
2
H Donors
0
Rotatable Bonds
1
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: C₁₁H₉ClFIN₂
Molecular Weight: 350.56
Synonyms: None
SMILES: N#CC1=C(I)C(F)=C(Cl)C=C1N2CCCC2
Tpsa: 27.03
Logp: 3.55558
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:
C₁₁H₉ClFIN₂
Molecular Weight:
350.56
Synonyms:
None
SMILES:
N#CC1=C(I)C(F)=C(Cl)C=C1N2CCCC2
Tpsa:
27.03
Logp:
3.55558
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: C₉H₈BrClO₃
Molecular Weight: 279.52
Synonyms: None
SMILES: O=C(OC)CC1=CC(Cl)=C(O)C(Br)=C1
Tpsa: 46.53
Logp: 2.5236
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:
C₉H₈BrClO₃
Molecular Weight:
279.52
Synonyms:
None
SMILES:
O=C(OC)CC1=CC(Cl)=C(O)C(Br)=C1
Tpsa:
46.53
Logp:
2.5236
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: C₇H₅BrFNO
Molecular Weight: 218.02
Synonyms: None
SMILES: O=CC1=CC(=NC(Br)=C1F)C
Tpsa: 29.96
Logp: 2.10412
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:
C₇H₅BrFNO
Molecular Weight:
218.02
Synonyms:
None
SMILES:
O=CC1=CC(=NC(Br)=C1F)C
Tpsa:
29.96
Logp:
2.10412
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: C₉H₉BrO₂
Molecular Weight: 229.07
Synonyms: None
SMILES: BrC1=C2C(C[C@@H](CO)O2)=CC=C1
Tpsa: 29.46
Logp: 1.7449
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:
C₉H₉BrO₂
Molecular Weight:
229.07
Synonyms:
None
SMILES:
BrC1=C2C(C[C@@H](CO)O2)=CC=C1
Tpsa:
29.46
Logp:
1.7449
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1