CS-1058023
1-Benzyl-3-methyl-1H-indole-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 854689-01-3
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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
C₁₇H₁₅NO₂
Molecular Weight
265.31
Synonyms
None
SMILES
O=C(O)C=1C=CC2=C(C1)C(=CN2CC=3C=CC=CC3)C
Tpsa
42.23
Logp
3.69622
H Acceptors
2
H Donors
1
Rotatable Bonds
3
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: C₁₇H₁₅NO₂
Molecular Weight: 265.31
Synonyms: None
SMILES: O=C(O)C=1C=CC2=C(C1)C(=CN2CC=3C=CC=CC3)C
Tpsa: 42.23
Logp: 3.69622
H Acceptors: 2
H Donors: 1
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:
C₁₇H₁₅NO₂
Molecular Weight:
265.31
Synonyms:
None
SMILES:
O=C(O)C=1C=CC2=C(C1)C(=CN2CC=3C=CC=CC3)C
Tpsa:
42.23
Logp:
3.69622
H Acceptors:
2
H Donors:
1
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: C₅HBr₂IO₂S
Molecular Weight: 411.84
Synonyms: None
SMILES: O=C(O)C=1SC(Br)=C(Br)C1I
Tpsa: 37.3
Logp: 3.5759
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:
C₅HBr₂IO₂S
Molecular Weight:
411.84
Synonyms:
None
SMILES:
O=C(O)C=1SC(Br)=C(Br)C1I
Tpsa:
37.3
Logp:
3.5759
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: C₆H₅IO₂S
Molecular Weight: 268.07
Synonyms: None
SMILES: O=C(O)C=1SC(I)=CC1C
Tpsa: 37.3
Logp: 2.35932
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:
C₆H₅IO₂S
Molecular Weight:
268.07
Synonyms:
None
SMILES:
O=C(O)C=1SC(I)=CC1C
Tpsa:
37.3
Logp:
2.35932
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: C₄H₆N₂OS
Molecular Weight: 130.17
Synonyms: None
SMILES: OC=1SC(=NC1C)N
Tpsa: 59.14
Logp: 0.73932
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₆N₂OS
Molecular Weight:
130.17
Synonyms:
None
SMILES:
OC=1SC(=NC1C)N
Tpsa:
59.14
Logp:
0.73932
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
0