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6-Chlorouracil

6-Chlorouracil structure

CAS No:
4270-27-3
Formula:
C4H3ClN2O2
Chemical Name:
6-Chlorouracil
Synonyms:
2,4(1H,3H)-Pyrimidinedione,6-chloro-;Uracil,6-chloro-;6-Chloro-2,4(1H,3H)-pyrimidinedione;4-Chloro-2,6-dihydroxypyrimidine;6-Chlorouracil;6-Chloro-2,4-pyrimidinediol;6-Chloro-2,4-dihydroxypyrimidine;6-Chloropyrimidine-2,4(1H,3H)-dione;NSC 210419;NSC 43265;6-Chloropyrimidine-2,4-dione
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

White to off-white powder

6-Chlorouracil Basic Attributes

Molecular Weight：

146.532

Exact Mass：

146.53

EC Number：

224-258-0

NSC Number：

210419|43265

DSSTox ID：

DTXSID70195396

HScode：

2933599090

Characteristics

PSA：

65.72000

XLogP3：

-0.3

Appearance：

White powder

Density：

1.6±0.1 g/cm3

Melting Point：

300 °C @ Solvent: Water

Boiling Point：

300°C

Refractive Index：

1.587

Water Solubility：

4.885g/L(25 ºC)

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S26-S36

Marks：

Xi:Irritant;

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 49 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

6-chlorouracil

6-Chlorouracil Use and Manufacturing

6-Chlorouracil acts as an inhibitor of yeast alcohol dehydrogenase (ADH-H). 6-Chlorouracil is a potential inhibitor of DNA repair glycosylases.

Computed Properties

Molecular Weight:146.53
XLogP3:-0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:145.9883050
Monoisotopic Mass:145.9883050
Topological Polar Surface Area:58.2
Heavy Atom Count:9
Complexity:199
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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