CS-0885146
4-Chloro-3-(1-cyanocyclopropyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1314765-89-3
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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
C₁₁H₈ClNO₂
Molecular Weight
221.64
Synonyms
None
SMILES
O=C(O)C1=CC=C(Cl)C(C2(C#N)CC2)=C1
Tpsa
61.09
Logp
2.59338
H Acceptors
2
H Donors
1
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: C₁₁H₈ClNO₂
Molecular Weight: 221.64
Synonyms: None
SMILES: O=C(O)C1=CC=C(Cl)C(C2(C#N)CC2)=C1
Tpsa: 61.09
Logp: 2.59338
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:
C₁₁H₈ClNO₂
Molecular Weight:
221.64
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(Cl)C(C2(C#N)CC2)=C1
Tpsa:
61.09
Logp:
2.59338
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: C₁₀H₈O₄
Molecular Weight: 192.17
Synonyms: None
SMILES: O=C(C1=CC=C(O2)C(CCC2=O)=C1)O
Tpsa: 63.6
Logp: 1.2364
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:
C₁₀H₈O₄
Molecular Weight:
192.17
Synonyms:
None
SMILES:
O=C(C1=CC=C(O2)C(CCC2=O)=C1)O
Tpsa:
63.6
Logp:
1.2364
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: C₇H₅ClINO₂
Molecular Weight: 297.48
Synonyms: None
SMILES: O=C(C1=NC=C(Cl)C(I)=C1)OC
Tpsa: 39.19
Logp: 2.1262
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:
C₇H₅ClINO₂
Molecular Weight:
297.48
Synonyms:
None
SMILES:
O=C(C1=NC=C(Cl)C(I)=C1)OC
Tpsa:
39.19
Logp:
2.1262
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: C₆H₃ClINO₂
Molecular Weight: 283.45
Synonyms: None
SMILES: O=C(C1=NC=C(Cl)C(I)=C1)O
Tpsa: 50.19
Logp: 2.0378
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:
C₆H₃ClINO₂
Molecular Weight:
283.45
Synonyms:
None
SMILES:
O=C(C1=NC=C(Cl)C(I)=C1)O
Tpsa:
50.19
Logp:
2.0378
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1