Basic information
- CAS
209959-33-1- Standard SMILES
CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ncc(Br)cn1- InChIKey
GDKYABNFMXOTAN-UHFFFAOYSA-N- Molecular formula
- C14H20BrN3O4
- Average molar mass
- 374.23 g/mol
- Monoisotopic mass
- 373.06372
Names & identifiers
- Preferred name
- tert-butyl N-(5-bromopyrimidin-2-yl)-N-((tert-butoxy)carbonyl)carbamate
- IUPAC
- tert-butyl N-(5-bromopyrimidin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
- English name
- 2-[Bis(tert-butoxycarbonyl)amino]-5-bromopyrimidine
- Molecular formula
- C14H20BrN3O4
- Molecular weight
- 374.23
Names & synonyms
tert-butyl N-(5-bromopyrimidin-2-yl)-N-[(tert-butoxy)carbonyl]carbamatetert-butyl N-(5-bromopyrimidin-2-yl)-N-((tert-butoxy)carbonyl)carbamateRefChem:896236696-598-1209959-33-12-[Bis(tert-Butoxycarbonyl)amino]-5-bromopyrimidine2-(N,N-BisBOC-Amino)-5-bromopyrimidineMFCD08275685C14H20BrN3O4Tert-butyl N-(5-bromopyrimidin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate2-[N,N-bis(tert-butoxycarbonyl)amino)-5-bromopyrimidin2-[N,N-bis(tert-butoxycarbonyl)amino]-5-bromopyrimidin
Show more names
N,N-bis-Boc-2-aMino-5-broMopyriMidine2-Amino-5-bromopyrimidine, 2,2-Bis-BOC protected(5-Bromopyrimidin-2-yl)bis(tert-butoxycarbonyl)aminedi-tert-butyl (5-bromopyrimidin-2-yl)imidodicarbonate2-[BIS(TERT-BUTOXYCARBONYL)AMINO]-5-BROMOPYRIMIDINE, 95+%2-[BIS(TERT-BUTOXYCARBONYL)AMINO]-5-BROMOPYRIMIDINE ISO 9001：2015 REACH
SCHEMBL2378220DTXSID90475066GDKYABNFMXOTAN-UHFFFAOYSA-NAKOS015836762tert-butyl N-(5-bromopyrimidin-2-yl)-N-[(tert- butoxy)carbonyl]carbamateSB18486SS-44365-Bromo-N,N-di-Boc-pyrimidin-2-amine
Database identifiers
- CAS
209959-33-1- PubChem CID
- 11977091
- DTXSID
DTXSID90475066- EC Number
- 696-598-1
- Nikkaji
- J2.362.822H
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 81.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 381
Physicochemical properties
- Boiling point
- 415.2 · 415.2±37.0 °C(Predicted)
- Density
- 1.39 · 1.390
- storage temp.
- Sealed in dry,Room Temperature
- pka
- -2.49 · -2.49±0.10(Predicted)
- Appearance
- white solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Acute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P261-P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers57 total
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
JiangXi Bobert Imp&Exp Co.,LTD18071643627 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Aladdin Scientific[email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
苏州施亚生物科技有限公司17715136450 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
安徽合诺生物科技有限公司18455579438
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
学研惠（武汉）科技有限公司15727060112 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
苏州施亚生物科技有限公司86(512)5235 8471 17715136450 · [email protected]
上海健超生物科技有限公司150-2103-5486 18017383231 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
金瓯生物医药（南京）有限公司13000000000 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海石洋化工有限公司021-56795766 · [email protected]
成都赛诺宁科技有限公司28-87999436 02887999436 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
康幸生物科技（上海）有限公司021-61556450 15800904410
武汉凯威斯科技有限公司027-67849912 · [email protected]
南京药石科技股份有限公司4000255188 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
南京麦瑞米生物技术有限公司025-87782433 18021532344 · [email protected]
Xuzhou B&C Chemical Technology Co., Ltd+86-400-0516-021 +86-15190678838 · [email protected]
济宁一泽医药科技有限公司15192473210 · [email protected]
成都爱斯特化学技术有限公司15928766785 15928766785 · [email protected]
聿锦（天津）科技有限公司13370351217 kungfu1217@1 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
上海珂华生物科技有限公司021-58581007 18019463053 · [email protected]
苏州诺行贸易有限公司0512-65816829 18662214788 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
郑州艾克姆化工有限公司13303867194 · [email protected]
山西诺诚生物科技有限公司17835231871 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
Related reactions
6 records
Compound notes
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