CS-0348194
Ethyl 2-((2-(2,5-dimethyl-1h-pyrrol-3-yl)-2-oxoethyl)thio)acetate
Manufacturer: ChemScene
CAS Number: 1152952-49-2
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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
C₁₂H₁₇NO₃S
Molecular Weight
255.33
Synonyms
None
SMILES
O=C(OCC)CSCC(C1=C(C)NC(C)=C1)=O
Tpsa
59.16
Logp
2.11054
H Acceptors
4
H Donors
1
Rotatable Bonds
6
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: C₁₂H₁₇NO₃S
Molecular Weight: 255.33
Synonyms: None
SMILES: O=C(OCC)CSCC(C1=C(C)NC(C)=C1)=O
Tpsa: 59.16
Logp: 2.11054
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:
C₁₂H₁₇NO₃S
Molecular Weight:
255.33
Synonyms:
None
SMILES:
O=C(OCC)CSCC(C1=C(C)NC(C)=C1)=O
Tpsa:
59.16
Logp:
2.11054
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: C₈H₁₂N₂O₂S₂
Molecular Weight: 232.32
Synonyms: None
SMILES: O=C(OCC)CSCC1=CSC(N)=N1
Tpsa: 65.21
Logp: 1.5216
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₂N₂O₂S₂
Molecular Weight:
232.32
Synonyms:
None
SMILES:
O=C(OCC)CSCC1=CSC(N)=N1
Tpsa:
65.21
Logp:
1.5216
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₆N₂O₃
Molecular Weight: 236.27
Synonyms: None
SMILES: O=C(OCC)N(C)CC(NC1=CC=CC=C1)=O
Tpsa: 58.64
Logp: 1.7134
H Acceptors: 3
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:
C₁₂H₁₆N₂O₃
Molecular Weight:
236.27
Synonyms:
None
SMILES:
O=C(OCC)N(C)CC(NC1=CC=CC=C1)=O
Tpsa:
58.64
Logp:
1.7134
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₃Cl₂NO₂
Molecular Weight: 214.09
Synonyms: Ethyl N,N-bis(2-chloroethyl)carbamate
SMILES: O=C(OCC)N(CCCl)CCCl
Tpsa: 29.54
Logp: 1.9225
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 5
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₃Cl₂NO₂
Molecular Weight:
214.09
Synonyms:
Ethyl N,N-bis(2-chloroethyl)carbamate
SMILES:
O=C(OCC)N(CCCl)CCCl
Tpsa:
29.54
Logp:
1.9225
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
5