CS-0867658
β-Cyano-3-methylbenzenepropanoic acid
Manufacturer: ChemScene
CAS Number: 1195653-13-4
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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
C₁₁H₁₁NO₂
Molecular Weight
189.21
Synonyms
None
SMILES
N#CC(CC(O)=O)C1=CC(C)=CC=C1
Tpsa
61.09
Logp
2.0769
H Acceptors
2
H Donors
1
Rotatable Bonds
3
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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: C₁₁H₁₁NO₂
Molecular Weight: 189.21
Synonyms: None
SMILES: N#CC(CC(O)=O)C1=CC(C)=CC=C1
Tpsa: 61.09
Logp: 2.0769
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:
C₁₁H₁₁NO₂
Molecular Weight:
189.21
Synonyms:
None
SMILES:
N#CC(CC(O)=O)C1=CC(C)=CC=C1
Tpsa:
61.09
Logp:
2.0769
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: C₁₂H₁₃NO₂
Molecular Weight: 203.24
Synonyms: None
SMILES: O=C(O)C1=CC=C(C#N)C(C(C)(C)C)=C1
Tpsa: 61.09
Logp: 2.55398
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:
C₁₂H₁₃NO₂
Molecular Weight:
203.24
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(C#N)C(C(C)(C)C)=C1
Tpsa:
61.09
Logp:
2.55398
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: C₁₁H₁₃ClO₂
Molecular Weight: 212.67
Synonyms: None
SMILES: O=C(O)C1=CC=C(Cl)C(C(C)(C)C)=C1
Tpsa: 37.3
Logp: 3.3357
H Acceptors: 1
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:
C₁₁H₁₃ClO₂
Molecular Weight:
212.67
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(Cl)C(C(C)(C)C)=C1
Tpsa:
37.3
Logp:
3.3357
H Acceptors:
1
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: C₁₁H₁₅NO₂
Molecular Weight: 193.24
Synonyms: None
SMILES: O=C(O)C1=CC=C(N)C(C(C)(C)C)=C1
Tpsa: 63.32
Logp: 2.2645
H Acceptors: 2
H Donors: 2
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:
C₁₁H₁₅NO₂
Molecular Weight:
193.24
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(N)C(C(C)(C)C)=C1
Tpsa:
63.32
Logp:
2.2645
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1