CS-0867651
2-(2-Cyanopropan-2-yl)benzoic acid
Manufacturer: ChemScene
CAS Number: 28310-36-3
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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
C₁₁H₁₁NO₂
Molecular Weight
189.21
Synonyms
None
SMILES
O=C(O)C1=CC=CC=C1C(C)(C#N)C
Tpsa
61.09
Logp
2.18598
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
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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: O=C(O)C1=CC=CC=C1C(C)(C#N)C
Tpsa: 61.09
Logp: 2.18598
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:
C₁₁H₁₁NO₂
Molecular Weight:
189.21
Synonyms:
None
SMILES:
O=C(O)C1=CC=CC=C1C(C)(C#N)C
Tpsa:
61.09
Logp:
2.18598
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: C₁₃H₂₀O₃Si
Molecular Weight: 252.38
Synonyms: None
SMILES: O=C(O)C1=CC=CC(O[Si](C)(C(C)(C)C)C)=C1
Tpsa: 46.53
Logp: 3.7688
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:
C₁₃H₂₀O₃Si
Molecular Weight:
252.38
Synonyms:
None
SMILES:
O=C(O)C1=CC=CC(O[Si](C)(C(C)(C)C)C)=C1
Tpsa:
46.53
Logp:
3.7688
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: C₁₁H₁₄N₂O₃
Molecular Weight: 222.24
Synonyms: None
SMILES: O=C(C1=NC=CC=C1NC(C(C)(C)C)=O)O
Tpsa: 79.29
Logp: 1.7644
H Acceptors: 3
H Donors: 2
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:
C₁₁H₁₄N₂O₃
Molecular Weight:
222.24
Synonyms:
None
SMILES:
O=C(C1=NC=CC=C1NC(C(C)(C)C)=O)O
Tpsa:
79.29
Logp:
1.7644
H Acceptors:
3
H Donors:
2
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: C₁₁H₁₃NO₅
Molecular Weight: 239.22
Synonyms: None
SMILES: O=C(O)C1=CC(C(C)(C)C)=CC([N+]([O-])=O)=C1O
Tpsa: 100.67
Logp: 2.2961
H Acceptors: 4
H Donors: 2
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:
C₁₁H₁₃NO₅
Molecular Weight:
239.22
Synonyms:
None
SMILES:
O=C(O)C1=CC(C(C)(C)C)=CC([N+]([O-])=O)=C1O
Tpsa:
100.67
Logp:
2.2961
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2