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Home Other Building Blocks 5-Carboxy-x-rhodamine triethylamin salt

5-Carboxy-x-rhodamine triethylamin salt

CAS No.:
216699-35-3
Catalog Number:
AG00BF5D
Molecular Formula:
C33H30N2O5
Molecular Weight:
534.6017
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$190
- +
10mg
98%
1 week
United States
$273
- +
50mg
98%
1 week
United States
$723
- +
Product Description
Catalog Number:
AG00BF5D
Chemical Name:
5-Carboxy-x-rhodamine triethylamin salt
CAS Number:
216699-35-3
Molecular Formula:
C33H30N2O5
Molecular Weight:
534.6017
MDL Number:
MFCD28355897
IUPAC Name:
3-carboxy-4-(3-oxa-23-aza-9-azoniaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4,9(28),13,15,18-heptaen-16-yl)benzoate
InChI:
InChI=1S/C33H30N2O5/c36-32(37)20-9-10-21(24(17-20)33(38)39)27-25-15-18-5-1-11-34-13-3-7-22(28(18)34)30(25)40-31-23-8-4-14-35-12-2-6-19(29(23)35)16-26(27)31/h9-10,15-17H,1-8,11-14H2,(H-,36,37,38,39)
InChI Key:
UNGMOMJDNDFGJG-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)C(=O)OC12c2cc3CCCN4c3c(c2Oc2c1cc1CCCN3c1c2CCC3)CCC4
Properties
Complexity:
1200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
534.215g/mol
Formal Charge:
0
Heavy Atom Count:
40  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
534.612g/mol
Monoisotopic Mass:
534.215g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  
Literature
Title Journal
Fluorescence resonance energy transfer dye-labeled probe for fluorescence-enhanced DNA detection: an effective strategy to greatly improve discrimination ability toward single-base mismatch. Biosensors & bioelectronics 20110915
Synthesis of 5- and 6-carboxy-X-rhodamines. Organic letters 20081106
Properties