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3-heptyl-2-[3-(3-heptyl-1,3-benzoxazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzoxazole

3-heptyl-2-[3-(3-heptyl-1,3-benzoxazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzoxazole structure

CAS No:
79953-80-3
Formula:
C31H41N2O2+
Chemical Name:
3-heptyl-2-[3-(3-heptyl-1,3-benzoxazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzoxazole
Synonyms:
3,3'-DHPCC;3,3'-diheptyloxycarbocyanine;DiOC(7);DiOC7(3);79953-80-3;SCHEMBL6150953;DTXSID001000857;(2E)-3-heptyl-2-[(E)-3-(3-heptyl-1,3-benzoxazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzoxazole;3-Heptyl-2-[3-(3-heptyl-1,3-benzoxazol-2(3H)-ylidene)prop-1-en-1-yl]-3H-1,3-benzoxazol-1-ium

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3-heptyl-2-[3-(3-heptyl-1,3-benzoxazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzoxazole Basic Attributes

Molecular Weight：

473.7 g/mol

Exact Mass：

473.316803555 g/mol

Characteristics

PSA：

29.5 Å²

Drug Information

MeSH Entry Terms：

3,3'-DHPCC

Computed Properties

Molecular Weight:473.7
XLogP3:10.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:14
Exact Mass:473.316803555
Monoisotopic Mass:473.316803555
Topological Polar Surface Area:29.5
Heavy Atom Count:35
Formal Charge:1
Complexity:608
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 1 pentanol; disodium pyrophosphate; calcium sulfate formula; denatonium benzoate; bromobenzene; formula for potassium sulphate

Guide of 3-heptyl-2-[3-(3-heptyl-1,3-benzoxazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzoxazole

Basic Attributes
Characteristics
Drug Information
Computed Properties

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