CS-0798961
2-(4-(1-Cyanocyclopropyl)phenyl)acetic acid
Manufacturer: ChemScene
CAS Number: 1314738-34-5
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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
C₁₂H₁₁NO₂
Molecular Weight
201.22
Synonyms
None
SMILES
OC(=O)CC1=CC=C(C=C1)C2(C#N)CC2
Tpsa
61.09
Logp
1.86888
H Acceptors
2
H Donors
1
Rotatable Bonds
3
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: C₁₂H₁₁NO₂
Molecular Weight: 201.22
Synonyms: None
SMILES: OC(=O)CC1=CC=C(C=C1)C2(C#N)CC2
Tpsa: 61.09
Logp: 1.86888
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:
C₁₂H₁₁NO₂
Molecular Weight:
201.22
Synonyms:
None
SMILES:
OC(=O)CC1=CC=C(C=C1)C2(C#N)CC2
Tpsa:
61.09
Logp:
1.86888
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: C₅H₁₃NO₂
Molecular Weight: 119.16
Synonyms: None
SMILES: COC[C@@H](N)CCO
Tpsa: 55.48
Logp: -0.6575
H Acceptors: 3
H Donors: 2
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:
C₅H₁₃NO₂
Molecular Weight:
119.16
Synonyms:
None
SMILES:
COC[C@@H](N)CCO
Tpsa:
55.48
Logp:
-0.6575
H Acceptors:
3
H Donors:
2
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: C₁₀H₉BrF₂
Molecular Weight: 247.08
Synonyms: None
SMILES: BrC1=CC=C(C=C1)C2(C(F)F)CC2
Tpsa: 0
Logp: 3.7458
H Acceptors: 0
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:
C₁₀H₉BrF₂
Molecular Weight:
247.08
Synonyms:
None
SMILES:
BrC1=CC=C(C=C1)C2(C(F)F)CC2
Tpsa:
0
Logp:
3.7458
H Acceptors:
0
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: C₁₅H₁₈ClN₃O₂S
Molecular Weight: 339.84
Synonyms: None
SMILES: CC(C)(C)OC(=O)N1CC2=C(CCC1)C3C(=NC=NC=3Cl)S2
Tpsa: 55.32
Logp: 4.028
H Acceptors: 5
H Donors: 0
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:
C₁₅H₁₈ClN₃O₂S
Molecular Weight:
339.84
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N1CC2=C(CCC1)C3C(=NC=NC=3Cl)S2
Tpsa:
55.32
Logp:
4.028
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
0