CS-0567059
2-(Cyanomethyl)-4,5-dimethoxybenzoic acid
Manufacturer: ChemScene
CAS Number: 76254-26-7
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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
C₁₁H₁₁NO₄
Molecular Weight
221.21
Synonyms
Benzoic acid, 2-(cyanomethyl)-4,5-dimethoxy-
SMILES
O=C(O)C1=CC(OC)=C(OC)C=C1CC#N
Tpsa
79.55
Logp
1.46808
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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: C₁₁H₁₁NO₄
Molecular Weight: 221.21
Synonyms: Benzoic acid, 2-(cyanomethyl)-4,5-dimethoxy-
SMILES: O=C(O)C1=CC(OC)=C(OC)C=C1CC#N
Tpsa: 79.55
Logp: 1.46808
H Acceptors: 4
H Donors: 1
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:
C₁₁H₁₁NO₄
Molecular Weight:
221.21
Synonyms:
Benzoic acid, 2-(cyanomethyl)-4,5-dimethoxy-
SMILES:
O=C(O)C1=CC(OC)=C(OC)C=C1CC#N
Tpsa:
79.55
Logp:
1.46808
H Acceptors:
4
H Donors:
1
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: C₆H₅ClN₂O₂
Molecular Weight: 172.57
Synonyms: 4-AMINO-3-CHLORO-PYRIDINE-2-CARBOXYLIC ACID
SMILES: O=C(C1=NC=CC(N)=C1Cl)O
Tpsa: 76.21
Logp: 1.0154
H Acceptors: 3
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:
C₆H₅ClN₂O₂
Molecular Weight:
172.57
Synonyms:
4-AMINO-3-CHLORO-PYRIDINE-2-CARBOXYLIC ACID
SMILES:
O=C(C1=NC=CC(N)=C1Cl)O
Tpsa:
76.21
Logp:
1.0154
H Acceptors:
3
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: C₁₀H₁₃NO₃
Molecular Weight: 195.22
Synonyms: Benzoic acid, 3-(aminomethyl)-4-methoxy-, methyl ester (9CI)
SMILES: O=C(OC)C1=CC=C(OC)C(CN)=C1
Tpsa: 61.55
Logp: 0.9405
H Acceptors: 4
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:
C₁₀H₁₃NO₃
Molecular Weight:
195.22
Synonyms:
Benzoic acid, 3-(aminomethyl)-4-methoxy-, methyl ester (9CI)
SMILES:
O=C(OC)C1=CC=C(OC)C(CN)=C1
Tpsa:
61.55
Logp:
0.9405
H Acceptors:
4
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: C₈H₅NO₂S
Molecular Weight: 179.20
Synonyms: None
SMILES: O=C(C1=CSC2=C1C=NC=C2)O
Tpsa: 50.19
Logp: 1.9945
H Acceptors: 3
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:
C₈H₅NO₂S
Molecular Weight:
179.20
Synonyms:
None
SMILES:
O=C(C1=CSC2=C1C=NC=C2)O
Tpsa:
50.19
Logp:
1.9945
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1