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ND(TMHD)3

ND(TMHD)3 structure

CAS No:
15492-47-4
Formula:
C33H57NdO6
Chemical Name:
ND(TMHD)3
Synonyms:
ND(TMHD)3;NEODYMIUM 2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATE;NEODYMIUM-THD;NEODYMIUM TRIS(2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATE);TRIS(2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATO)NEODYMIUM;TRIS(2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATO)NEODYMIUM(III);Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)neodymium(III),99%(99.9%-Nd)(REO)[Nd(TMHD)3];Neodymium-dpm~Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)neodymium(III)
Categories:
Organic Chemistry > Organometallic Compounds

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ND(TMHD)3 Basic Attributes

Molecular Weight：

694.04

Exact Mass：

691.32300

DSSTox ID：

DTXSID10329996

Characteristics

PSA：

78.90000

XLogP3：

9.03750

Appearance：

light purple crystal

Melting Point：

209-212°C

Boiling Point：

270°C

Flash Point：

270°C

Vapor Pressure：

0.287mmHg at 25°C

Safety Information

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (90.48%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:697.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:694.34672
Monoisotopic Mass:694.34672
Topological Polar Surface Area:112
Heavy Atom Count:40
Complexity:801
Undefined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:4
Compound Is Canonicalized:Yes