 Home > Encyclopedia > Cyclotriveratrylene

Cyclotriveratrylene

Cyclotriveratrylene structure

CAS No:
1180-60-5
Formula:
C27H30O6
Chemical Name:
Cyclotriveratrylene
Synonyms:
5H-Tribenzo[a,d,g]cyclononene,10,15-dihydro-2,3,7,8,12,13-hexamethoxy-;10,15-Dihydro-2,3,7,8,12,13-hexamethoxy-5H-tribenzo[a,d,g]cyclononene;Cyclotriveratrylene;Cycloveratril;Cycloveratryl;NSC 119127;NSC 627660
Categories:
Organic Chemistry > Heterocyclic Ring

Request for Quotation

Description

WHITE POWDER

Cyclotriveratrylene Basic Attributes

Molecular Weight：

450.531

Exact Mass：

450.52

UNII：

N3F2J3T2ZN

NSC Number：

627660|119127

DSSTox ID：

DTXSID40297912

HScode：

29093090

Characteristics

PSA：

55.4

XLogP3：

5.6

Density：

1.1183 (rough estimate)

Melting Point：

234 °C

Boiling Point：

518.6°C (rough estimate)

Refractive Index：

1.6000 (estimate)

Collision Cross Section：

213.9 Å² [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

Safety Information

safety instructions：

24/25

Drug Information

MeSH Entry Terms：

CTV cpd

Computed Properties

Molecular Weight:450.5
XLogP3:5.6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:450.20423867
Monoisotopic Mass:450.20423867
Topological Polar Surface Area:55.4
Heavy Atom Count:33
Complexity:472
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes