CS-0460042
2-(Hydroxymethyl)-2-methyltetrahydrothiophene 1,1-dioxide
Manufacturer: ChemScene
CAS Number: 1780745-87-0
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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
C₆H₁₂O₃S
Molecular Weight
164.22
Synonyms
None
SMILES
OCC1(C)CCCS1(=O)=O
Tpsa
54.37
Logp
-0.054
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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: C₆H₁₂O₃S
Molecular Weight: 164.22
Synonyms: None
SMILES: OCC1(C)CCCS1(=O)=O
Tpsa: 54.37
Logp: -0.054
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:
C₆H₁₂O₃S
Molecular Weight:
164.22
Synonyms:
None
SMILES:
OCC1(C)CCCS1(=O)=O
Tpsa:
54.37
Logp:
-0.054
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: C₂₄H₃₇N₃O₅
Molecular Weight: 447.57
Synonyms: None
SMILES: O=C([C@H]1N(C([C@H](C)N2C(N(C3CCCCC3)C([C@@H]2CCC)=O)=O)=O)[C@@]4([H])CCCC[C@@]4([H])C1)O
Tpsa: 98.23
Logp: 3.3848
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₃₇N₃O₅
Molecular Weight:
447.57
Synonyms:
None
SMILES:
O=C([C@H]1N(C([C@H](C)N2C(N(C3CCCCC3)C([C@@H]2CCC)=O)=O)=O)[C@@]4([H])CCCC[C@@]4([H])C1)O
Tpsa:
98.23
Logp:
3.3848
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₇NO₃
Molecular Weight: 211.26
Synonyms: HJIKFDMILLVWHA-GUBZILKMSA-N
SMILES: O=C([C@H]1N(C(C)=O)[C@@]2([H])CCCC[C@@]2([H])C1)O
Tpsa: 57.61
Logp: 1.2506
H Acceptors: 2
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:
C₁₁H₁₇NO₃
Molecular Weight:
211.26
Synonyms:
HJIKFDMILLVWHA-GUBZILKMSA-N
SMILES:
O=C([C@H]1N(C(C)=O)[C@@]2([H])CCCC[C@@]2([H])C1)O
Tpsa:
57.61
Logp:
1.2506
H Acceptors:
2
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: C₆H₁₀O₄S
Molecular Weight: 178.21
Synonyms: 2-Carboxy-2-methyltetrahydrothiophene 1,1-dioxide
SMILES: O=C(C1(C)CCCS1(=O)=O)O
Tpsa: 71.44
Logp: 0.0383
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:
C₆H₁₀O₄S
Molecular Weight:
178.21
Synonyms:
2-Carboxy-2-methyltetrahydrothiophene 1,1-dioxide
SMILES:
O=C(C1(C)CCCS1(=O)=O)O
Tpsa:
71.44
Logp:
0.0383
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1