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CAS 100-85-6 Benzyltrimethylammonium Hydroxide (40% in Water) molecular structure lightbox
CAS RN: 100-85-6

Benzyltrimethylammonium Hydroxide (40% in Water)

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  • Product code: ICTB0378
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100-85-6 / benzyl(trimethyl)azanium hydroxide

Benzyltrimethylammonium hydroxide | 100-85-6 | Triton B

Standard CAS: 100-85-6 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
100-85-6
Multi CAS
Yes
Molecular Formula
C10H17NO
Molecular Weight
167.250000
Exact Mass
167.131014
SMILES
C[N+](C)(C)CC1=CC=CC=C1.[OH-]
InChI
InChI=1S/C10H16N.H2O/c1-11(2,3)9-10-7-5-4-6-8-10;/h4-8H,9H2,1-3H3;1H2/q+1;/p-1
InChIKey
NDKBVBUGCNGSJJ-UHFFFAOYSA-M
Synonyms
Benzyltrimethylammonium hydroxide 100-85-6 Triton B Trimethylbenzylammonium hydroxide Benzyl trimethyl ammonium hydroxide

Physical Properties

Physical Description
Clear to light yellow liquid with an amine odor; Miscible in water
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
12
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
TPSA
1.0000

Safety & Transport

Pictogram(s)
Flammable Corrosive
Signal
Danger
GHS Hazard Statements
H224 (12.6%): Extremely flammable liquid and vapor [Danger Flammable liquids] H314 (99.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H318 (64.3%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P363, P370+P378, P403+P235, P405, and P501

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