CS-0569751
Tert-butyl 3-(benzoylthio)azetidine-1-carboxylate
Manufacturer: ChemScene
CAS Number: 1323999-80-9
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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
C₁₅H₁₉NO₃S
Molecular Weight
293.38
Synonyms
1-Azetidinecarboxylic acid, 3-(benzoylthio)-, 1,1-dimethylethyl ester
SMILES
O=C(N1CC(SC(C2=CC=CC=C2)=O)C1)OC(C)(C)C
Tpsa
46.61
Logp
3.1793
H Acceptors
4
H Donors
0
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
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: C₁₅H₁₉NO₃S
Molecular Weight: 293.38
Synonyms: 1-Azetidinecarboxylic acid, 3-(benzoylthio)-, 1,1-dimethylethyl ester
SMILES: O=C(N1CC(SC(C2=CC=CC=C2)=O)C1)OC(C)(C)C
Tpsa: 46.61
Logp: 3.1793
H Acceptors: 4
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:
C₁₅H₁₉NO₃S
Molecular Weight:
293.38
Synonyms:
1-Azetidinecarboxylic acid, 3-(benzoylthio)-, 1,1-dimethylethyl ester
SMILES:
O=C(N1CC(SC(C2=CC=CC=C2)=O)C1)OC(C)(C)C
Tpsa:
46.61
Logp:
3.1793
H Acceptors:
4
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: C₁₀H₁₁NOS
Molecular Weight: 193.27
Synonyms: S-?3-?Azetidinyl benzenecarbothioate
SMILES: O=C(SC1CNC1)C=2C=CC=CC2
Tpsa: 29.1
Logp: 1.5318
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:
C₁₀H₁₁NOS
Molecular Weight:
193.27
Synonyms:
S-?3-?Azetidinyl benzenecarbothioate
SMILES:
O=C(SC1CNC1)C=2C=CC=CC2
Tpsa:
29.1
Logp:
1.5318
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: C₈H₈N₄O₂
Molecular Weight: 192.17
Synonyms: 7-allyl-1-purine-2,6(3H,7H)-dione 7-allyl-1-purine-2,6(3H,7H)-dione
SMILES: O=C1NC(=O)C2=C(N=CN2CC=C)N1
Tpsa: 83.54
Logp: -0.4011
H Acceptors: 4
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:
C₈H₈N₄O₂
Molecular Weight:
192.17
Synonyms:
7-allyl-1-purine-2,6(3H,7H)-dione 7-allyl-1-purine-2,6(3H,7H)-dione
SMILES:
O=C1NC(=O)C2=C(N=CN2CC=C)N1
Tpsa:
83.54
Logp:
-0.4011
H Acceptors:
4
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: C₁₆H₁₂FNO₄
Molecular Weight: 301.27
Synonyms: None
SMILES: C1C2=CC=CC=C2C(=O)N1C(C3=C(C=CC(=C3)F)O)C(=O)O
Tpsa: 77.84
Logp: 2.313
H Acceptors: 3
H Donors: 2
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:
C₁₆H₁₂FNO₄
Molecular Weight:
301.27
Synonyms:
None
SMILES:
C1C2=CC=CC=C2C(=O)N1C(C3=C(C=CC(=C3)F)O)C(=O)O
Tpsa:
77.84
Logp:
2.313
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3