4-Methoxybenzyl carbazate - CAS 18912-37-3
Catalog: |
BB014593 |
Product Name: |
4-Methoxybenzyl carbazate |
CAS: |
18912-37-3 |
Synonyms: |
(4-methoxyphenyl)methyl N-aminocarbamate |
IUPAC Name: | (4-methoxyphenyl)methyl N-aminocarbamate |
Description: | 4-Methoxybenzyl carbazate (CAS# 18912-37-3) is a useful research chemical. |
Molecular Weight: | 196.20 |
Molecular Formula: | C9H12N2O3 |
Canonical SMILES: | COC1=CC=C(C=C1)COC(=O)NN |
InChI: | InChI=1S/C9H12N2O3/c1-13-8-4-2-7(3-5-8)6-14-9(12)11-10/h2-5H,6,10H2,1H3,(H,11,12) |
InChI Key: | JKBMMHKEAGEILO-UHFFFAOYSA-N |
Boiling Point: | 391.1 °C at 760 mmHg |
Density: | 1.209 g/cm3 |
MDL: | MFCD00042817 |
LogP: | 1.88630 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021005900-A1 | Method of generating energy from a hydrazide containing anode fuel, and fuel cell | 20190508 |
TW-201806949-A | Substitution of 5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-A]pyridine-3(2H)-one and 2,5,6,7-tetrahydro-3H -pyrrolo[2,1-C][1,2,4]triazol-3-one and use thereof | 20160509 |
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Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.08479225 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.08479225 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 73.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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