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CHEMBRDG-BB 4010698

CHEMBRDG-BB 4010698 structure

CHEMBRDG-BB 4010698 

structure
  • CAS No:

    1015845-80-3

  • Formula:

    C9H17N3

  • Chemical Name:

    CHEMBRDG-BB 4010698

  • Synonyms:

    CHEMBRDG-BB 4010698;N-Isobutyl-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-amine;2-METHYL-N-[(1-METHYL-1H-PYRAZOL-4-YL)METHYL]PROPAN-1-AMINE;ALINDA 16641;IFLAB-BB F2169-0298;UKRORGSYN-BB BBV-153863;2-methyl-N-[(1-methyl-1H-pyrazol-4-yl)methyl]propan-1-amine(SALTDATA: FREE)

CHEMBRDG-BB 4010698 Basic Attributes

167.25138

167.14200

DTXSID00654704

2933199090

Characteristics

29.85000

1.55660

1.00±0.1 g/cm3(Predicted)

251.9±15.0 °C(Predicted)

Safety Information

IRRITANT

Xi

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:167.25
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:167.142247555
Monoisotopic Mass:167.142247555
Topological Polar Surface Area:29.8
Heavy Atom Count:12
Complexity:125
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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