CS-0347289
Methyl 3-(((5-amino-1,3,4-thiadiazol-2-yl)thio)methyl)benzoate
Manufacturer: ChemScene
CAS Number: 923213-21-2
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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
C₁₁H₁₁N₃O₂S₂
Molecular Weight
281.35
Synonyms
None
SMILES
O=C(OC)C1=CC=CC(CSC2=NN=C(N)S2)=C1
Tpsa
78.1
Logp
2.1992
H Acceptors
7
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: C₁₁H₁₁N₃O₂S₂
Molecular Weight: 281.35
Synonyms: None
SMILES: O=C(OC)C1=CC=CC(CSC2=NN=C(N)S2)=C1
Tpsa: 78.1
Logp: 2.1992
H Acceptors: 7
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:
C₁₁H₁₁N₃O₂S₂
Molecular Weight:
281.35
Synonyms:
None
SMILES:
O=C(OC)C1=CC=CC(CSC2=NN=C(N)S2)=C1
Tpsa:
78.1
Logp:
2.1992
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₁NO₃
Molecular Weight: 193.20
Synonyms: Methyl 3-(acetylamino)benzoate
SMILES: O=C(OC)C1=CC=CC(NC(C)=O)=C1
Tpsa: 55.4
Logp: 1.4316
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₁NO₃
Molecular Weight:
193.20
Synonyms:
Methyl 3-(acetylamino)benzoate
SMILES:
O=C(OC)C1=CC=CC(NC(C)=O)=C1
Tpsa:
55.4
Logp:
1.4316
H Acceptors:
3
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: C₁₁H₁₃NO₃
Molecular Weight: 207.23
Synonyms: Benzoic acid, 3-(acetylamino)-2-Methyl-, Methyl ester
SMILES: O=C(OC)C1=CC=CC(NC(C)=O)=C1C
Tpsa: 55.4
Logp: 1.74002
H Acceptors: 3
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:
C₁₁H₁₃NO₃
Molecular Weight:
207.23
Synonyms:
Benzoic acid, 3-(acetylamino)-2-Methyl-, Methyl ester
SMILES:
O=C(OC)C1=CC=CC(NC(C)=O)=C1C
Tpsa:
55.4
Logp:
1.74002
H Acceptors:
3
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: C₁₁H₁₅NO₂
Molecular Weight: 193.24
Synonyms: Benzoic acid, 3-[(1-methylethyl)amino]-, methyl ester
SMILES: O=C(OC)C1=CC=CC(NC(C)C)=C1
Tpsa: 38.33
Logp: 2.2935
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:
C₁₁H₁₅NO₂
Molecular Weight:
193.24
Synonyms:
Benzoic acid, 3-[(1-methylethyl)amino]-, methyl ester
SMILES:
O=C(OC)C1=CC=CC(NC(C)C)=C1
Tpsa:
38.33
Logp:
2.2935
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3