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Home> Hot Product Listed T   > T5347841
680-31-9 structure

T5347841

Iupac Name:N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine
CAS No.:680-31-9
Molecular Weight:179.20000
Molecular Formula:C10H12CLN (isomer)
Names and Identifiers
Synonyms

(4-tert-butyl-2,6-dimethylphenyl)methyl 4-cyanobenzoate AC1MT630 MCULE-4079428168 MOLPORT-005-840-494 OPREA1_265113 Z18373007 ZINC5937198

Inchi
InChI=1S/C6H18N3OP/c1-7(2)11(10,8(3)4)9(5)6/h1-6H3
InChkey
GNOIPBMMFNIUFM-UHFFFAOYSA-N
Canonical Smiles
CN(C)P(=O)(N(C)C)N(C)C
Properties
Melting Point
7°C(lit.)
Vapour
0.07 mm Hg ( 25 °C)
Refractive Index
n20/D 1.459(lit.)
Safety and Handling
Risk Statements
R45; R46
Safety Statements
S53-S45
HazardClass
6.1(b)
Hazard Note
H340; H350
PackingGroup
III
Transport
2810
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 680-31-9 EC: T5347841 ·ECHA C&L Inventory for CAS: CAS: 680-31-9 EC: T5347841
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Germ cell mutagenicity, Category 1B

Carcinogenicity, Category 1B

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H340 May cause genetic defects

H350 May cause cancer

Precautionary statement(s)
Prevention

P201 Obtain special instructions before use.

P202 Do not handle until all safety precautions have been read and understood.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

Response

P308+P313 IF exposed or concerned: Get medical advice/ attention.

Storage

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:179.20000g/mol
  • Molecular Formula:C10H12CLN
  • Compound Is Canonicalized:True
  • XLogP3-AA:0.3
  • Exact Mass:179.119
  • Monoisotopic Mass:179.119
  • Complexity:139
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:26.8A^2
  • Heavy Atom Count:11
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceBjIAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAFAAAgCAAAAAAAAQCAAIAAAAA QAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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Recommended Suppliers
  • Tel:0086-571-86722205
  • Fax:0086-571-86722205
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  • Fax:86-571-88938652
  • Tel:0086-27-59207850
  • Fax:0086-27-59524646
  • Tel:86-571-85829152
  • Fax:86-571-85829153
  • Tel:+86-0592-5567629
  • Fax:+86-0592-5567629
  • Tel:86-25-83697070
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  • Tel:86-571-86960370
  • Fax:86-571-86940780
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  • Tel:86-1732-7098554
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