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22-NBDCHOLESTEROL

22-NBDCHOLESTEROL structure

CAS No:
78949-95-8
Formula:
C28H38N4O4
Chemical Name:
22-NBDCHOLESTEROL
Synonyms:
N-(7-nitrobenz-2-oxa-1,3-diazole)-23,24-dinor-5-cholen-22-amine-3beta-ol;NBD cholesterol [22-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)aMino)-23,24-bisnor-5-cholen-3b-ol];NBD cholesterol, 90%;Pregn-5-en-3-ol, 20-methyl-21-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-, (3β,20S)-
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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22-NBDCHOLESTEROL Basic Attributes

Molecular Weight：

494.63

Exact Mass：

494.28930571 g/mol

Characteristics

PSA：

117 Å²

Density：

1.27±0.1 g/cm3

Boiling Point：

650.5±65.0 °C(Predicted)

PKA：

15.03±0.70

Safety Information

wgk germany：

safety instructions：

22-24/25

Drug Information

MeSH Entry Terms：

N-(7-nitrobenz-2-oxa-1,3-diazole)-23,24-dinor-5-cholen-22-amine-3beta-ol

Computed Properties

Molecular Weight:494.6
XLogP3:6.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:494.28930571
Monoisotopic Mass:494.28930571
Topological Polar Surface Area:117
Heavy Atom Count:36
Complexity:893
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 78949-95-8

Grade: Industrial Grade

Content: 99%

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