CS-0201391
tert-Butyl 2-(4-bromothiazol-2-yl)-2-cyanoacetate
Manufacturer: ChemScene
CAS Number: 2276736-92-4
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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
C₁₀H₁₁BrN₂O₂S
Molecular Weight
303.18
Synonyms
2-Thiazoleacetic acid, 4-bromo-α-cyano-, 1,1-dimethylethyl ester
SMILES
O=C(OC(C)(C)C)C(C#N)C1=NC(Br)=CS1
Tpsa
62.98
Logp
2.85448
H Acceptors
5
H Donors
0
Rotatable Bonds
2
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: C₁₀H₁₁BrN₂O₂S
Molecular Weight: 303.18
Synonyms: 2-Thiazoleacetic acid, 4-bromo-α-cyano-, 1,1-dimethylethyl ester
SMILES: O=C(OC(C)(C)C)C(C#N)C1=NC(Br)=CS1
Tpsa: 62.98
Logp: 2.85448
H Acceptors: 5
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:
C₁₀H₁₁BrN₂O₂S
Molecular Weight:
303.18
Synonyms:
2-Thiazoleacetic acid, 4-bromo-α-cyano-, 1,1-dimethylethyl ester
SMILES:
O=C(OC(C)(C)C)C(C#N)C1=NC(Br)=CS1
Tpsa:
62.98
Logp:
2.85448
H Acceptors:
5
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: C₉H₁₅BrO₄
Molecular Weight: 267.12
Synonyms: None
SMILES: BrC[C@@H]1[C@]2([H])[C@](OC(C)(O2)C)([H])[C@@H](O1)OC
Tpsa: 36.92
Logp: 1.2727
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:
C₉H₁₅BrO₄
Molecular Weight:
267.12
Synonyms:
None
SMILES:
BrC[C@@H]1[C@]2([H])[C@](OC(C)(O2)C)([H])[C@@H](O1)OC
Tpsa:
36.92
Logp:
1.2727
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁NO
Molecular Weight: 149.19
Synonyms: rac-(1R,2R)-2-amino-2,3-dihydro-1H-inden-1-ol hydrochloride, trans
SMILES: O[C@H]1C2=CC=CC=C2C[C@@H]1N
Tpsa: 46.25
Logp: 0.6034
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁NO
Molecular Weight:
149.19
Synonyms:
rac-(1R,2R)-2-amino-2,3-dihydro-1H-inden-1-ol hydrochloride, trans
SMILES:
O[C@H]1C2=CC=CC=C2C[C@@H]1N
Tpsa:
46.25
Logp:
0.6034
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
0
Purity: 97%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇ClO₂
Molecular Weight: 182.60
Synonyms: 7-Chloro-2,3-dihydro-4-hydroxy-1H-inden-1-one
SMILES: O=C1CCC2=C1C(Cl)=CC=C2O
Tpsa: 37.3
Logp: 2.1745
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇ClO₂
Molecular Weight:
182.60
Synonyms:
7-Chloro-2,3-dihydro-4-hydroxy-1H-inden-1-one
SMILES:
O=C1CCC2=C1C(Cl)=CC=C2O
Tpsa:
37.3
Logp:
2.1745
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0