CS-0074503
Methyl 4-(2-sulfanylidene-2,3-dihydro-1H-1,3-benzodiazol-1-yl)butanoate
Manufacturer: ChemScene
CAS Number: 1507763-03-2
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₁₄N₂O₂S
Molecular Weight
250.32
Synonyms
1H-Benzimidazole-1-butanoic acid, 2,3-dihydro-2-thioxo-, methyl ester
SMILES
S=C1N(CCCC(OC)=O)C2=CC=CC=C2N1
Tpsa
47.02
Logp
2.65209
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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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
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₄N₂O₂S
Molecular Weight: 250.32
Synonyms: 1H-Benzimidazole-1-butanoic acid, 2,3-dihydro-2-thioxo-, methyl ester
SMILES: S=C1N(CCCC(OC)=O)C2=CC=CC=C2N1
Tpsa: 47.02
Logp: 2.65209
H Acceptors: 4
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:
C₁₂H₁₄N₂O₂S
Molecular Weight:
250.32
Synonyms:
1H-Benzimidazole-1-butanoic acid, 2,3-dihydro-2-thioxo-, methyl ester
SMILES:
S=C1N(CCCC(OC)=O)C2=CC=CC=C2N1
Tpsa:
47.02
Logp:
2.65209
H Acceptors:
4
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: C₆H₁₄O
Molecular Weight: 102.17
Synonyms: [S,(+)]-2,3-Dimethyl-1-butanol
SMILES: OC[C@@H](C)C(C)C
Tpsa: 20.23
Logp: 1.2708
H Acceptors: 1
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:
C₆H₁₄O
Molecular Weight:
102.17
Synonyms:
[S,(+)]-2,3-Dimethyl-1-butanol
SMILES:
OC[C@@H](C)C(C)C
Tpsa:
20.23
Logp:
1.2708
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: MFCD28165977
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉NO₄
Molecular Weight: 183.16
Synonyms: None
SMILES: O=C1C=C(OC)C(C(O)=O)=CN1C
Tpsa: 68.53
Logp: 0.0921
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
MFCD28165977
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₉NO₄
Molecular Weight:
183.16
Synonyms:
None
SMILES:
O=C1C=C(OC)C(C(O)=O)=CN1C
Tpsa:
68.53
Logp:
0.0921
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: MFCD08692087
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₈O₃
Molecular Weight: 140.14
Synonyms: 2,4-Dimethylfuran-3-carboxylic acid
SMILES: O=C(O)C1=C(C)OC=C1C
Tpsa: 50.44
Logp: 1.59464
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
MFCD08692087
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₈O₃
Molecular Weight:
140.14
Synonyms:
2,4-Dimethylfuran-3-carboxylic acid
SMILES:
O=C(O)C1=C(C)OC=C1C
Tpsa:
50.44
Logp:
1.59464
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1