CS-0516018
1-(Tert-butyl) 4-methyl 6-bromo-1H-indole-1,4-dicarboxylate
Manufacturer: ChemScene
CAS Number: 1440807-02-2
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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
C₁₅H₁₆BrNO₄
Molecular Weight
354.20
Synonyms
6-Bromo-indole-1,4-dicarboxylic acid 1-tert-butyl ester 4-methyl ester
SMILES
O=C(N1C=CC2=C1C=C(Br)C=C2C(OC)=O)OC(C)(C)C
Tpsa
57.53
Logp
3.9736
H Acceptors
5
H Donors
0
Rotatable Bonds
1
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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: C₁₅H₁₆BrNO₄
Molecular Weight: 354.20
Synonyms: 6-Bromo-indole-1,4-dicarboxylic acid 1-tert-butyl ester 4-methyl ester
SMILES: O=C(N1C=CC2=C1C=C(Br)C=C2C(OC)=O)OC(C)(C)C
Tpsa: 57.53
Logp: 3.9736
H Acceptors: 5
H Donors: 0
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:
C₁₅H₁₆BrNO₄
Molecular Weight:
354.20
Synonyms:
6-Bromo-indole-1,4-dicarboxylic acid 1-tert-butyl ester 4-methyl ester
SMILES:
O=C(N1C=CC2=C1C=C(Br)C=C2C(OC)=O)OC(C)(C)C
Tpsa:
57.53
Logp:
3.9736
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD13195783
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₆N₂O₂
Molecular Weight: 208.26
Synonyms: N-T-Butyl-2-methoxynicotinamide
SMILES: O=C(NC(C)(C)C)C1=C(OC)N=CC=C1
Tpsa: 51.22
Logp: 1.6185
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD13195783
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₆N₂O₂
Molecular Weight:
208.26
Synonyms:
N-T-Butyl-2-methoxynicotinamide
SMILES:
O=C(NC(C)(C)C)C1=C(OC)N=CC=C1
Tpsa:
51.22
Logp:
1.6185
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: C₁₃H₁₄F₃NO₃
Molecular Weight: 289.25
Synonyms: Benzeneacetic acid, 4-(acetylamino)-α,α,2-trifluoro-5-methyl-, ethyl ester
SMILES: O=C(OCC)C(F)(C1=CC(C)=C(NC(C)=O)C=C1F)F
Tpsa: 55.4
Logp: 2.74742
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:
C₁₃H₁₄F₃NO₃
Molecular Weight:
289.25
Synonyms:
Benzeneacetic acid, 4-(acetylamino)-α,α,2-trifluoro-5-methyl-, ethyl ester
SMILES:
O=C(OCC)C(F)(C1=CC(C)=C(NC(C)=O)C=C1F)F
Tpsa:
55.4
Logp:
2.74742
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: C₁₅H₁₃NO
Molecular Weight: 223.27
Synonyms: 5-(2-Methoxy-phenyl)-1H-indole
SMILES: COC1=CC=CC=C1C1=C/C2=C(\C=C/1)NC=C2
Tpsa: 25.02
Logp: 3.8435
H Acceptors: 1
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:
C₁₅H₁₃NO
Molecular Weight:
223.27
Synonyms:
5-(2-Methoxy-phenyl)-1H-indole
SMILES:
COC1=CC=CC=C1C1=C/C2=C(\C=C/1)NC=C2
Tpsa:
25.02
Logp:
3.8435
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2