Diphenylcarbamoyl chloride - CAS 83-01-2

Catalog:	BB036950
Product Name:	Diphenylcarbamoyl chloride
CAS:	83-01-2
Synonyms:	N,N-diphenylcarbamoyl chloride

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

QC Data

IUPAC Name:	N,N-diphenylcarbamoyl chloride
Description:	Diphenylcarbamoyl chloride (CAS# 83-01-2) is a useful research chemical compound.
Molecular Weight:	231.68
Molecular Formula:	C13H10ClNO
Canonical SMILES:	C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)Cl
InChI:	InChI=1S/C13H10ClNO/c14-13(16)15(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChI Key:	XNBKKRFABABBPM-UHFFFAOYSA-N
Boiling Point:	361.8 °C at 760 mmHg
Melting Point:	81-85 °C
Purity:	95 %
Density:	1.269 g/cm³
Appearance:	Beige to grey-green crystalline powder
Storage:	Refrigerator
LogP:	4.18350

Publication Number	Title	Priority Date
CN-112538051-A	Benzimidazole fluorescent probe for trifluralin detection and synthesis method thereof	20201217
WO-2021182457-A1	Novel 3,5-diaminobenzoic acid compound, and pin1 inhibitor and therapeutic agent for inflammatory diseases using same	20200312
US-2021238213-A1	SOLID-PHASE SYNTHESIS OF OLIGONUCLEOTIDES CONTAINING N6-(2-DEOXY-ALPHA,BETA-DERYTHROPENTOFURANOSYL)-2,6-DIAMINO-4-HYDROXY-5-FORMAMIDOPYRIMIDINE (Fapy.dG)	20200128
CN-111205203-A	Benzophenone derivative containing diphenyl carbamate group and preparation and application thereof	20191202
CN-111205203-B	Benzophenone derivative containing diphenyl carbamate group and preparation and application thereof	20191202

PMID	Publication Date	Title	Journal
14567548	20030801	Carbonic anhydrase inhibitors. Inhibition of cytosolic isozymes I and II and transmembrane, cancer-associated isozyme IX with lipophilic sulfonamides	Journal of enzyme inhibition and medicinal chemistry
11916148	20011101	Antimycobacterial activity of 3,4-dichlorophenyl-ureas, N,N-diphenyl-ureas and related derivatives	Journal of enzyme inhibition

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Related Functional Groups

Carbonyl Compounds

[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[55441-25-3]
1-(2-Cyanophenyl)urea
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P261, P264, P272, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P333+P313, P363, P405, and P501
Signal Word:	Danger

Complexity:	214
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	231.0450916
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	231.0450916
Rotatable Bond Count:	2
Topological Polar Surface Area:	20.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.8