CS-0880221
4-(Cyanomethyl)-3-methylbenzoic acid
Manufacturer: ChemScene
CAS Number: 1824586-67-5
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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
C₁₀H₉NO₂
Molecular Weight
175.18
Synonyms
None
SMILES
O=C(O)C1=CC=C(CC#N)C(C)=C1
Tpsa
61.09
Logp
1.7593
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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: C₁₀H₉NO₂
Molecular Weight: 175.18
Synonyms: None
SMILES: O=C(O)C1=CC=C(CC#N)C(C)=C1
Tpsa: 61.09
Logp: 1.7593
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:
C₁₀H₉NO₂
Molecular Weight:
175.18
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(CC#N)C(C)=C1
Tpsa:
61.09
Logp:
1.7593
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁NO₂
Molecular Weight: 165.19
Synonyms: None
SMILES: O=C(O)C1=CC=C(CN)C(C)=C1
Tpsa: 63.32
Logp: 1.15192
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁NO₂
Molecular Weight:
165.19
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(CN)C(C)=C1
Tpsa:
63.32
Logp:
1.15192
H Acceptors:
2
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: C₉H₁₀O₃
Molecular Weight: 166.17
Synonyms: None
SMILES: O=C(O)C1=CC=C(CO)C(C)=C1
Tpsa: 57.53
Logp: 1.18552
H Acceptors: 2
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:
C₉H₁₀O₃
Molecular Weight:
166.17
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(CO)C(C)=C1
Tpsa:
57.53
Logp:
1.18552
H Acceptors:
2
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: C₁₀H₁₃NO₄S
Molecular Weight: 243.28
Synonyms: None
SMILES: O=C(O)C1=CC=C(S(=O)(N(C)C)=O)C(C)=C1
Tpsa: 74.68
Logp: 0.94352
H Acceptors: 3
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:
C₁₀H₁₃NO₄S
Molecular Weight:
243.28
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(S(=O)(N(C)C)=O)C(C)=C1
Tpsa:
74.68
Logp:
0.94352
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3