3D Mol Similar

Thiourea

: IUPAC이름：thiourea; CAS 레지스트리 번호: 62-56-6; 분자 무게：76.12

견적을 보내다

1. 이름 및 식별자

: 1.1 제품명; Thiourea; 1.2 동의어; Sulfourea, Thiocarbamide, Thiourea

1.3 CAS 레지스트리 번호: 62-56-6

1.4 CID: 2723790

1.5 EINECS 번호: 200-543-5

1.6 분자식: NH2CSNH2 (isomer)

1.7 Inchi: InChI=1S/CH4N2S/c2-1(3)4/h(H4,2,3,4)

1.8 InchiKey: UMGDCJDMYOKAJW-UHFFFAOYSA-N

1.9 교회법에 의거 한 SMILES: C(=S)(N)N

1.10 이성질체 SMILES: C(=S)(N)N

2. 속성

2.1 밀도: 1.405

2.2 융해점: 171-175℃

2.3 비등점: 349 to 352° F (NTP, 1992)

2.4 굴절 인덱스: 1.637 (30 C)

2.5 번쩍이는 점: 66.8 °C

2.6 PSA: 84.13000

2.7 logP: 0.58930

2.8 가용성: 13.6 g/100 mL (20 °C)

2.9 PH: 6-8 (50g/l, H2O, 20℃)

2.10 pKa: -1.0(at 25℃)

3. 보안 및 처리

3.1 위험 기호: Xn

3.2 위험 코드: R22;R40;R51/53;R63

3.3 위험 범주: 6.1

3.4 위험성 설명: H302-H351-H361d-H411

3.5 WGK 독일: 2

3.6 RTECS: YU2800000

4. MSDS 정보

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

Carcinogenicity, Category 2

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 2

Reproductive toxicity, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word	Warning
Hazard statement(s)	H302 Harmful if swallowed H351 Suspected of causing cancer H411 Toxic to aquatic life with long lasting effects
Precautionary statement(s)
Prevention	P264 Wash ... thoroughly after handling. P270 Do not eat, drink or smoke when using this product. P201 Obtain special instructions before use. P202 Do not handle until all safety precautions have been read and understood. P280 Wear protective gloves/protective clothing/eye protection/face protection. P273 Avoid release to the environment.
Response	P301+P312 IF SWALLOWED: Call a POISON CENTER/doctor/\u2026if you feel unwell. P330 Rinse mouth. P308+P313 IF exposed or concerned: Get medical advice/ attention. P391 Collect spillage.
Storage	P405 Store locked up.
Disposal	P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

5. NMR 스펙트럼

Mass spectrum (electron ionization)

6. 합성 선형

62-56-6Total: 1 합성 선형

3129-90-6

62-56-6 429 공급자

문헌:
Synthetic Communications, , vol. 44, # 3 p. 340 - 345
공장: null

7. 전구체 및 제품

업스트림 제품:

3129-90-6

다운스트림 제품 :

82118-18-1

2986-19-8

8. 화학 데이터 계산

분자량: 76.117g/mol
분자식: CH₄N₂S
Compound Is Canonicalized: True
XLogP3-AA: -0.8
Exact Mass: 76.00951931
Monoisotopic Mass: 76.00951931
Complexity: 29
Rotatable Bond Count: 0
Hydrogen Bond Donor Count: 2
Hydrogen Bond Acceptor Count: 1
Topological Polar Surface Area: 84.1
Heavy Atom Count: 4
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADcYADAABAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAQQAAAAAAAAAAABAABAAAAEAAAAAAAAAAAAAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

9. 질문 및 답변

What is Thiourea and How is it Used in Various Industries? Apr 15 2024
Introduction: Thiourea is a compound with important chemical significance that plays an important role in the chemical field. Thiourea is an organic compound containing sulfur and nitrogen, which has..
What is the use of thiourea Apr 15 2024
Introduction : Thiourea is a widely used compound that plays an important role in many fields. This article aims to explore the use of Thiourea and study its application and potential in different fi..
What is the difference between urea and thiourea? Feb 25 2022
Visualize a carbon with its four bonds being two methyl (CH3) groups and a double-bonded oxygen (called a keto group.) This is urea. Replace the oxygen with a sulfur (which is right under oxygen on th..
Why is thiourea a monodentate ligand? Jul 04 2021
I was going through a list of monodentate ligands, and I came across examples like HX2OHX2O (which has 2 lone pairs), BrX?BrX? , IX?IX? (both of them have more than one lone pair). Similarly, thioure..

10. 권장 공급업체

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Dayang Chem (Hangzhou) Co., Ltd. Diamond member

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Products:Chemical products
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Purity:99%Packing: 200kg/bag FOB
Price: 1 USD/metric ton
Time: 2024/06/17

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Factory Supply industrial grade Thiourea CAS No 62-56-6 factory outlet

Purity:99%Packing: 200kg/bag FOB
Price: 20 USD/g
Time: 2024/11/15

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Hangzhou Dingyan Chem Co.,Ltd Diamond member

1YR

Products:Export business of hi-tech products such as pharmaceutical materials (APIs), pharmaceutical intermediates, fine chemicals and biochemical reagents, etc.
Tel:86-571-86465881
Email:sales9@dingyanchem.com

THIOUREA