CS-0525385
2-(2-Cyano-4-hydroxyphenyl)acetic acid
Manufacturer: ChemScene
CAS Number: 1261572-62-6
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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
C₉H₇NO₃
Molecular Weight
177.16
Synonyms
2-Cyano-4-hydroxyphenylacetic acid
SMILES
O=C(O)CC1=CC=C(O)C=C1C#N
Tpsa
81.32
Logp
0.89098
H Acceptors
3
H Donors
2
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: C₉H₇NO₃
Molecular Weight: 177.16
Synonyms: 2-Cyano-4-hydroxyphenylacetic acid
SMILES: O=C(O)CC1=CC=C(O)C=C1C#N
Tpsa: 81.32
Logp: 0.89098
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:
C₉H₇NO₃
Molecular Weight:
177.16
Synonyms:
2-Cyano-4-hydroxyphenylacetic acid
SMILES:
O=C(O)CC1=CC=C(O)C=C1C#N
Tpsa:
81.32
Logp:
0.89098
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: C₁₀H₈ClNO₂
Molecular Weight: 209.63
Synonyms: None
SMILES: O=C(OC)CC1=CC=C(Cl)C(C#N)=C1
Tpsa: 50.09
Logp: 1.92718
H Acceptors: 3
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:
C₁₀H₈ClNO₂
Molecular Weight:
209.63
Synonyms:
None
SMILES:
O=C(OC)CC1=CC=C(Cl)C(C#N)=C1
Tpsa:
50.09
Logp:
1.92718
H Acceptors:
3
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: C₉H₈N₂O₂
Molecular Weight: 176.17
Synonyms: 4-(2-Nitro-ethyl)-benzonitrile
SMILES: N#CC1=CC=C(CC[N+]([O-])=O)C=C1
Tpsa: 66.93
Logp: 1.37748
H Acceptors: 3
H Donors: 0
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:
C₉H₈N₂O₂
Molecular Weight:
176.17
Synonyms:
4-(2-Nitro-ethyl)-benzonitrile
SMILES:
N#CC1=CC=C(CC[N+]([O-])=O)C=C1
Tpsa:
66.93
Logp:
1.37748
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD18399135
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇F₃O₃
Molecular Weight: 220.15
Synonyms: Benzoic acid, 3-(difluoromethoxy)-4-fluoro-, methyl ester
SMILES: O=C(OC)C1=CC=C(F)C(OC(F)F)=C1
Tpsa: 35.53
Logp: 2.2137
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD18399135
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇F₃O₃
Molecular Weight:
220.15
Synonyms:
Benzoic acid, 3-(difluoromethoxy)-4-fluoro-, methyl ester
SMILES:
O=C(OC)C1=CC=C(F)C(OC(F)F)=C1
Tpsa:
35.53
Logp:
2.2137
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3